3-(4-chlorophenyl)sulfanyl-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)propanamide

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)propanamide Openeye Name: 3-(4-chlorophenyl)sulfanyl-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)propanamide CAS Name: 3-[(4-chlorophenyl)thio]-N-[2-methoxy-5-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: 3-(4-chlorophenyl)sulfanyl-N-(2-methoxy-5-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: 3-[(4-chlorophenyl)thio]-N-(2-methoxy-5-pyrrolidinosulfonyl-phenyl)propionamide 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)CCSC3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)NC(=O)CCSC3=CC=C(C=C3)Cl

InChI

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