AG000BCR

116-42-7 | Benzamide, N-[(4-aminophenyl)sulfonyl]-4-(1-methylethoxy)-

AG000BCR

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CAS Number	116-42-7
Catalog Number	AG000BCR(AGN-PC-0JL7JM)
Chemical Name	Benzamide, N-[(4-aminophenyl)sulfonyl]-4-(1-methylethoxy)-
EC Number	204-140-5
IUPAC Name	N-(4-aminophenyl)sulfonyl-4-propan-2-yloxybenzamide
InChI	InChI=1S/C16H18N2O4S/c1-11(2)22-14-7-3-12(4-8-14)16(19)18-23(20,21)15-9-5-13(17)6-10-15/h3-11H,17H2,1-2H3,(H,18,19)
InChI Key	FBFBRAFXKGRRHI-UHFFFAOYSA-N
MDL Number	MFCD00233642
Molecular Formula	C16H18N2O4S
Molecular Weight	334.3901
NSC Number	120646
SMILES	NC1=CC=C(C=C1)S(=O)(=O)NC(C1=CC=C(C=C1)OC(C)C)=O
UNII	YR841R53VW
Synonyms	N-((4-aminophenyl)sulfonyl)-4-(1-methylethoxy)benzamide, sulfaproxyline, Sulfaproxyline, Sulphaproxyline, Sulfaproxylin, 116-42-7, Sulfaproxiline, UNII-YR841R53VW, p-Isopropoxy-N-sulfanilylbenzamide, N(sup1)-(4-Isopropoxybenzoyl)sulfanilamide, N(sup1)-(p-Isopropoxybenzoyl)sulfanilamide, YR841R53VW, N(sup1)-(4-Isopropoxybenzoyl)-p-aminobenzenesulfonamide, p-((4-Isopropoxybenzoyl)amino)benzenesulfonamide, Sulfaproxylinum, Sulfaproxilina, Benzamide, N-[(4-aminophenyl)sulfonyl]-4-(1-methylethoxy)-, p-[(4-Isopropoxybenzoyl)amino]benzenesulfonamide, Sulfaproxyline [INN:BAN], Sulfaproxylinum [INN-Latin], Sulfaproxilina [INN-Spanish], EINECS 204-140-5, NSC 120646, AC1Q6UF3, G 14289, SCHEMBL149839, AC1L26N2, ZINC2103, CHEMBL2107520, NSC120646, Benzamide, p-isopropoxy-N-sulfanilyl-, N1-(4-Isopropoxybenzoyl)sulfanilamide, CS-6583, NSC-120646, HY-101829, N(sup 1)-(4-Isopropoxybenzoyl)sulfanilamide, Benzamide, p-isopropoxy-N-sulfanilyl- (8CI), G 13289, N-(4-aminophenyl)sulfonyl-4-propan-2-yloxybenzamide, Benzamide, N-((4-aminophenyl)sulfonyl)-4-(1-methylethoxy)- (9CI), Dosulfin, Sulfaproxyline [INN], CID67002, AR-1I7018, C16-H18-N2-O4-S, N1-(p-isopropoxybenzoyl)sulfanilamide, Benzamide, N-((4-aminophenyl)sulfonyl)-4-(1-methylethoxy)-, 1184-42-5,

Complexity	485
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	334.099g/mol
Formal Charge	0
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	334.39g/mol
Monoisotopic Mass	334.099g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	107A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

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