(3E)-3-[[3-methoxy-5-[(4-methylphenyl)sulfanylmethyl]-4-oxidanyl-phenyl]methylidene]pyrrolidin-2-one

Systemtic Name: (3E)-3-[[3-methoxy-5-[(4-methylphenyl)sulfanylmethyl]-4-oxidanyl-phenyl]methylidene]pyrrolidin-2-one Openeye Name: (3E)-3-[[4-hydroxy-3-methoxy-5-(p-tolylsulfanylmethyl)phenyl]methylene]pyrrolidin-2-one CAS Name: (3E)-3-[[4-hydroxy-3-methoxy-5-[[(4-methylphenyl)thio]methyl]phenyl]methylidene]-2-pyrrolidinone IUPAC Name: (3E)-3-[[4-hydroxy-3-methoxy-5-[(4-methylphenyl)sulfanylmethyl]phenyl]methylidene]pyrrolidin-2-one Traditional Name: (3E)-3-[4-hydroxy-3-methoxy-5-[(p-tolylthio)methyl]benzylidene]-2-pyrrolidone Formula: C20H21NO3S MolecularWeight: 355.45064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=C(C(=CC(=C2)C=C3CCNC3=O)OC)O

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=C(C(=CC(=C2)/C=C/3\CCNC3=O)OC)O

InChI

InChI=1S/C20H21NO3S/c1-13-3-5-17(6-4-13)25-12-16-10-14(11-18(24-2)19(16)22)9-15-7-8-21-20(15)23/h3-6,9-11,22H,7-8,12H2,1-2H3,(H,21,23)/b15-9+