N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-3-phenylsulfanyl-propanamide

Systemtic Name: N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-3-phenylsulfanyl-propanamide Openeye Name: N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-3-phenylsulfanyl-propanamide CAS Name: N-[2-methoxy-5-(1-pyrrolidinylsulfonyl)phenyl]-3-(phenylthio)propanamide IUPAC Name: N-(2-methoxy-5-pyrrolidin-1-ylsulfonylphenyl)-3-phenylsulfanylpropanamide Traditional Name: N-(2-methoxy-5-pyrrolidinosulfonyl-phenyl)-3-(phenylthio)propionamide Formula: C20H24N2O4S2 MolecularWeight: 420.54556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O4S2/c1-26-19-10-9-17(28(24,25)22-12-5-6-13-22)15-18(19)21-20(23)11-14-27-16-7-3-2-4-8-16/h2-4,7-10,15H,5-6,11-14H2,1H3,(H,21,23)