4-[(4-chlorophenyl)sulfanylmethyl]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)benzamide

Systemtic Name: 4-[(4-chlorophenyl)sulfanylmethyl]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)benzamide Openeye Name: 4-[(4-chlorophenyl)sulfanylmethyl]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)benzamide CAS Name: 4-[[(4-chlorophenyl)thio]methyl]-N-[2-methoxy-5-(1-pyrrolidinylsulfonyl)phenyl]benzamide IUPAC Name: 4-[(4-chlorophenyl)sulfanylmethyl]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonylphenyl)benzamide Traditional Name: 4-[[(4-chlorophenyl)thio]methyl]-N-(2-methoxy-5-pyrrolidinosulfonyl-phenyl)benzamide Formula: C25H25ClN2O4S2 MolecularWeight: 517.06

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)NC(=O)C3=CC=C(C=C3)CSC4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)NC(=O)C3=CC=C(C=C3)CSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H25ClN2O4S2/c1-32-24-13-12-22(34(30,31)28-14-2-3-15-28)16-23(24)27-25(29)19-6-4-18(5-7-19)17-33-21-10-8-20(26)9-11-21/h4-13,16H,2-3,14-15,17H2,1H3,(H,27,29)