4-methoxy-N-[4-(phenylsulfanylmethyl)phenyl]-3-pyrrolidin-1-ylcarbonyl-benzenesulfonamide

Systemtic Name: 4-methoxy-N-[4-(phenylsulfanylmethyl)phenyl]-3-pyrrolidin-1-ylcarbonyl-benzenesulfonamide Openeye Name: 4-methoxy-N-[4-(phenylsulfanylmethyl)phenyl]-3-(pyrrolidine-1-carbonyl)benzenesulfonamide CAS Name: 4-methoxy-3-[oxo(1-pyrrolidinyl)methyl]-N-[4-[(phenylthio)methyl]phenyl]benzenesulfonamide IUPAC Name: 4-methoxy-N-[4-(phenylsulfanylmethyl)phenyl]-3-(pyrrolidine-1-carbonyl)benzenesulfonamide Traditional Name: 4-methoxy-N-[4-[(phenylthio)methyl]phenyl]-3-(pyrrolidine-1-carbonyl)benzenesulfonamide Formula: C25H26N2O4S2 MolecularWeight: 482.61494

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)CSC3=CC=CC=C3)C(=O)N4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)CSC3=CC=CC=C3)C(=O)N4CCCC4

InChI

InChI=1S/C25H26N2O4S2/c1-31-24-14-13-22(17-23(24)25(28)27-15-5-6-16-27)33(29,30)26-20-11-9-19(10-12-20)18-32-21-7-3-2-4-8-21/h2-4,7-14,17,26H,5-6,15-16,18H2,1H3