(5Z)-5-[(4-dimethylaminophenyl)methylidene]-2-(1-methylimidazol-2-yl)sulfanyl-4-oxidanyl-4-(4-phenylbutyl)cyclopent-2-en-1-one

Systemtic Name: (5Z)-5-[(4-dimethylaminophenyl)methylidene]-2-(1-methylimidazol-2-yl)sulfanyl-4-oxidanyl-4-(4-phenylbutyl)cyclopent-2-en-1-one Openeye Name: (5Z)-5-[(4-dimethylaminophenyl)methylene]-4-hydroxy-2-(1-methylimidazol-2-yl)sulfanyl-4-(4-phenylbutyl)cyclopent-2-en-1-one CAS Name: (5Z)-5-[(4-dimethylaminophenyl)methylidene]-4-hydroxy-2-[(1-methyl-2-imidazolyl)thio]-4-(4-phenylbutyl)-1-cyclopent-2-enone IUPAC Name: (5Z)-5-[(4-dimethylaminophenyl)methylidene]-4-hydroxy-2-(1-methylimidazol-2-yl)sulfanyl-4-(4-phenylbutyl)cyclopent-2-en-1-one Traditional Name: (5Z)-5-[4-(dimethylamino)benzylidene]-4-hydroxy-2-[(1-methylimidazol-2-yl)thio]-4-(4-phenylbutyl)cyclopent-2-en-1-one Formula: C28H31N3O2S MolecularWeight: 473.62964

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC2=CC(C(=CC3=CC=C(C=C3)N(C)C)C2=O)(CCCCC4=CC=CC=C4)O

Isomeric SMILES

CN1C=CN=C1SC2=CC(/C(=C/C3=CC=C(C=C3)N(C)C)/C2=O)(CCCCC4=CC=CC=C4)O

InChI

InChI=1S/C28H31N3O2S/c1-30(2)23-14-12-22(13-15-23)19-24-26(32)25(34-27-29-17-18-31(27)3)20-28(24,33)16-8-7-11-21-9-5-4-6-10-21/h4-6,9-10,12-15,17-20,33H,7-8,11,16H2,1-3H3/b24-19+