2-[(3-chlorophenyl)methylsulfanyl]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[(3-chlorophenyl)methylsulfanyl]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-[(3-chlorophenyl)methylsulfanyl]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)acetamide CAS Name: 2-[(3-chlorophenyl)methylthio]-N-[2-methoxy-5-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[(3-chlorophenyl)methylsulfanyl]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(3-chlorobenzyl)thio]-N-(2-methoxy-5-pyrrolidinosulfonyl-phenyl)acetamide Formula: C20H23ClN2O4S2 MolecularWeight: 454.99062

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)NC(=O)CSCC3=CC(=CC=C3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)NC(=O)CSCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H23ClN2O4S2/c1-27-19-8-7-17(29(25,26)23-9-2-3-10-23)12-18(19)22-20(24)14-28-13-15-5-4-6-16(21)11-15/h4-8,11-12H,2-3,9-10,13-14H2,1H3,(H,22,24)