AG003FCA

135-57-9 | 2,2-Dithiobisbenzanilide

AG003FCA

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CAS Number	135-57-9
Catalog Number	AG003FCA(AGN-PC-0JL7PJ)
Chemical Name	2,2-Dithiobisbenzanilide
EC Number	205-201-9
IUPAC Name	N-[2-[(2-benzamidophenyl)disulfanyl]phenyl]benzamide
InChI	InChI=1S/C26H20N2O2S2/c29-25(19-11-3-1-4-12-19)27-21-15-7-9-17-23(21)31-32-24-18-10-8-16-22(24)28-26(30)20-13-5-2-6-14-20/h1-18H,(H,27,29)(H,28,30)
InChI Key	ZHMIOPLMFZVSHY-UHFFFAOYSA-N
MDL Number	MFCD00043806
Molecular Formula	C26H20N2O2S2
Molecular Weight	456.5792
SMILES	O=C(NC1=CC=CC=C1SSC2=CC=CC=C2NC(C3=CC=CC=C3)=O)C4=CC=CC=C4
UNII	10X28GH3DL
Synonyms	135-57-9, Bis(2-benzamidophenyl) disulfide, Peptazin BAFD, Peptisant 1O, Pepton 22, 2,2'-Dibenzoylaminodiphenyl disulfide, Bis(o-benzamidophenyl) disulfide, o,o'-Dibenzamidodiphenyl disulfide, 2,2'-Dibenzamidodiphenyl disulfide, 2',2'''-Dithiodibenzanilide, Di-o-benzamidophenyl disulphide, 2',2'''-Dithiobisbenzanilide, Bis-o-benzoylaminofenyl-disulfid, o-(Benzoylamino)phenyl disulfide, N,N'-Dithiodi-o-phenylenedibenzamide, UNII-10X28GH3DL, Benzamide, N,N'-(dithiodi-2,1-phenylene)bis-, N,N'-(Dithiodi-2,1-phenylene)bisbenzamide, Benzanilide, 2',2'''-dithiobis-, 2,2'-Dibenzamido diphenyl disulfide, EINECS 205-201-9, BRN 0721443, Bis-o-benzoylaminofenyl-disulfid [Czech], Benzamide, N,N'-(dithiodiphenylene)bis-, 10X28GH3DL, CHEMBL118148, Di-O-benzamidodiphenyl disulfide, MFCD00043806, N-[2-[(2-benzamidophenyl)disulfanyl]phenyl]benzamide, DSSTox_CID_21629, DSSTox_RID_79796, DSSTox_GSID_41629, Bis(2-benzamidophenyl)disulfide, Bis[2-benzamidophenyl]disulfide, CAS-135-57-9, Pepton-22, 2,2-Dithiobisbenzanilide, 2,2'-Dithiodibenzanilide, ACMC-209c3t, 2-Benzamidophenyl disulfide, EC 205-201-9, 2,2\'-Dithiobisbenzanilide, SCHEMBL34933, di-o-benzamidophenyldisulphide, 3-13-00-00917 (Beilstein Handbook Reference), bis(o-benzamidophenyl)disulfide, Jsp002154, DTXSID7041629, CTK2G4305, Bis(2-benzamidophenyl) disulphide, ZHMIOPLMFZVSHY-UHFFFAOYSA-N, bis-(2-Benzamidophenyl) disulfide, 2,2'-Dibenzamido-diphenyl-disulfid, AC1L2772, ZINC2023619, Tox21_201711, Tox21_303466, ANW-19959, BDBM50369603, AKOS001584775, MCULE-1706931755, NCGC00249100-01, NCGC00257433-01, NCGC00259260-01, AN-23104, CJ-31580, LS-27652, TC-108704, D1102, FT-0622997, N,N'-[dithiobis(2,1-phenylene)]dibenzamide, ST50411248, A806954, I01-1616, J-006721, N,N'-(Disulfanediylbis(2,1-phenylene))dibenzamide, N,N'-(2,2'-disulfanediylbis(2,1-phenylene))dibenzamide, N-(2-{[2-(benzoylamino)phenyl]disulfanyl}phenyl)benzamide, 2,2 inverted exclamation mark -dibenzoylaminodiphenyldisulfide, N-(2-([2-(Benzoylamino)phenyl]disulfanyl)phenyl)benzamide #, n,n inverted exclamation mark -(dithiodi-2,1-phenylene)bis-benzamid, n,n inverted exclamation mark -(dithiodi-2,1-phenylene)bisbenzamide, phenyl-N-(2-{[2-(phenylcarbonylamino)phenyl]disulfanyl}phenyl)carboxamide, 2 inverted exclamation mark ,2 inverted exclamation mark inverted exclamation mark inverted exclamation mark -dithiobis-benzanilid, 79313-17-0, 2,2'-Dithiobisbenzanilide, C26H20N2O2S2, CID67271, 2,2/'-Dibenzoylaminodiphenyl disulfide, C26-H20-N2-O2-S2, Benzamida, N,N'-(ditiodi-2,1-fenileno) bis-, DBD,

Complexity	553
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	456.097g/mol
Formal Charge	0
Heavy Atom Count	32
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	456.578g/mol
Monoisotopic Mass	456.097g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	109A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	5.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H319
Packing Group
Precautionary statements	P264-P305+P351+P338+P337+P313
UN Code

Certificate of Analysis

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