2-[2-[(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[2-[(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(4-methylphenyl)ethanamide Openeye Name: 2-[2-(4-chloro-3-pyrrolidin-1-ylsulfonyl-anilino)-2-oxo-ethyl]sulfanyl-N-(p-tolyl)acetamide CAS Name: 2-[[2-[4-chloro-3-(1-pyrrolidinylsulfonyl)anilino]-2-oxoethyl]thio]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[2-(4-chloro-3-pyrrolidin-1-ylsulfonylanilino)-2-oxoethyl]sulfanyl-N-(4-methylphenyl)acetamide Traditional Name: 2-[[2-(4-chloro-3-pyrrolidinosulfonyl-anilino)-2-keto-ethyl]thio]-N-(p-tolyl)acetamide Formula: C21H24ClN3O4S2 MolecularWeight: 482.01596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSCC(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSCC(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H24ClN3O4S2/c1-15-4-6-16(7-5-15)23-20(26)13-30-14-21(27)24-17-8-9-18(22)19(12-17)31(28,29)25-10-2-3-11-25/h4-9,12H,2-3,10-11,13-14H2,1H3,(H,23,26)(H,24,27)