AG003U3W

117976-90-6 | Rabeprazole sodium

AG003U3W

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CAS Number	117976-90-6
Catalog Number	AG003U3W(AGN-PC-0PB8KC)
Chemical Name	Rabeprazole sodium
IUPAC Name	sodium;2-[[4-(3-methoxypropoxy)-3-methylpyridin-2-yl]methylsulfinyl]benzimidazol-1-ide
InChI	InChI=1S/C18H20N3O3S.Na/c1-13-16(19-9-8-17(13)24-11-5-10-23-2)12-25(22)18-20-14-6-3-4-7-15(14)21-18;/h3-4,6-9H,5,10-12H2,1-2H3;/q-1;+1
InChI Key	KRCQSTCYZUOBHN-UHFFFAOYSA-N
MDL Number	MFCD02092688
Molecular Formula	C18H20N3NaO3S
Molecular Weight	381.4245
SMILES	O=S(C1=NC2=CC=CC=C2[N-]1)CC3=NC=CC(OCCCOC)=C3C.[Na+]
Synonyms	1H-Benzimidazole, 2-(((4-(3-methoxypropoxy)-3-methyl-2-pyridinyl)methyl)sulfinyl)-, sodium salt, 2-((4-(3-methoxypropoxy)-3-methylpyridin-2-yl)methylsulfinyl)-1H-benzimidazole, Aciphex, dexrabeprazole, E 3810, E3810, LY 307640, LY-307640, LY307640, Pariet, rabeprazole, rabeprazole sodium, Sodium, Rabeprazole, RABEPRAZOLE SODIUM, 117976-90-6, Rebeprazole sodium, Pariet, Rabeprazole sodium salt, Aciphex Sodium, LY 307640 sodium, Habeprazole Sodium, Rabeprazole sodium [USAN], LY-307640, E 3810, (S)-Rabeprazole Sodium Salt, CHEBI:8769, Sodium rabeprazole, AK-94764, 2-(((4-(3-Methoxypropoxy)-3-methyl-2-pyridyl)methyl)sulfinyl)benzimidazole sodium salt, DSSTox_CID_24205, DSSTox_RID_80118, C18H20N3NaO3S, DSSTox_GSID_44205, 1H-Benzimidazole, 2-(((4-(3-methoxypropoxy)-3-methyl-2-pyridinyl)methyl)sulfinyl)-, sodium salt, LY307640, Q-201655, Rabicip, Pepcia, Aciphex Sprinkle, sodium 2-({[4-(3-methoxypropoxy)-3-methylpyridin-2-yl]methyl}sulfinyl)benzimidazol-1-ide, sodium;2-[[4-(3-methoxypropoxy)-3-methylpyridin-2-yl]methylsulfinyl]benzimidazol-1-ide, SMR000550493, CAS-117976-90-6, NCGC00159518-02, pariete, Pariprazole sodium, Rebeprazole sodium;, Aciphex (TN), Pariet (TN), Rebeprazole sodium salt, 2-([4-(3-Methoxypropoxy)-3-methylpyridin-2-yl]methylsulfinyl)-1H-benzo[d]imidazole, LY307640 sodium, AC1Q1W5D, MLS001165734, MLS006010621, C18H20N3O3S.Na, SCHEMBL140494, CHEMBL1200930, DTXSID3044205, CTK8E9030, EX-A176, KRCQSTCYZUOBHN-UHFFFAOYSA-N, Rabeprazole sodium (JP17/USAN), HMS2093H10, HMS2231E04, HMS3373B05, BCP06639, KS-00000H0Y, Tox21_111736, Tox21_302317, AC-715, BG0517, CR0021, MFCD02092688, s4665, Rabeprazole sodium, >=98% (HPLC), AKOS015895734, AKOS015962116, AKOS025310160, Tox21_111736_1, AM81231, API0004026, CCG-213574, RTC-063564, NCGC00159518-05, NCGC00255838-01, 1H-Benzimidazole, 2-[[[4-(3-methoxypropoxy)-3-methyl-2-pyridinyl]methyl]sulfinyl]-, sodium salt (1:1), AN-15565, AS-13338, BC208315, H932, SC-19471, AB0013367, AX8150186, LS-172366, TC-063564, TL8000495, FT-0631090, R0115, ST24049115, C07865, D00724, J10481, S-7685, 976R906, SR-01000799133, J-010726, SR-01000799133-2, [2-[[4-(3-methoxypropoxy)-3-methyl-2-pyridyl]methylsulfinyl]benzimidazol-1-yl]sodium, natrium-2-({[4-(3-methoxypropoxy)-3-methylpyridin-2-yl]methyl}sulfinyl)benzimidazol-1-id, sodium 2-((4-(3-methoxypropoxy)-3-methylpyridin-2-yl)methylsulfinyl)benzo[d]imidazol-1-ide, sodium 2-[[4-(3-methoxypropoxy)-3-methyl-2-pyridyl]methylsulfinyl]benzimidazol-1-ide, sodium;2-[(R)-[4-(3-methoxypropoxy)-3-methylpyridin-2-yl]methylsulfinyl]benzimidazol-1-ide, 171440-19-0, 1H-Benzimidazole,2-(((4-(3-methoxypropxy)-3-methyl-2-pyridinyl)methyl)sufinyl)-,sodium salt, 1H-Benzimidazole,2-[[[4-(3-methoxypropoxy)- 3-methyl-2-pyridinyl]methyl]sulfinyl]-,sodium salt, 2-[[[4-(3-methoxypropoxy)-3-methyl-2-pyridinyl]-methyl]sulfinyl]-1 H -benzimidazole sodium salt, Aciphex, rabeprazole, dexrabeprazole, Dexrabeprazole sodium, Rabeprazole (sodium), Sodium, Rabeprazole, UNII-3L36P16U4R, C18H21N3O3S.Na, (R)-(+)-Rabeprazole sodium, 3L36P16U4R, E3810, CID60681, C18-H21-N3-O3-S.Na, ACN-029561, CS-O-02219, E-3810, LY 307640, D064750, 2-((4-(3-methoxypropoxy)-3-methylpyridin-2-yl)methylsulfinyl)-1H-benzimidazole, 171440-18-9, sodium 2-((4-(3-methoxypropoxy)-3-methylpyridin-2-yl)methylsulfinyl)-2,3-dihydrobenzo[d]imidazol-1-ide,

Complexity	446
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	381.112g/mol
Formal Charge	0
Heavy Atom Count	26
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	381.426g/mol
Monoisotopic Mass	381.112g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	81.5A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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