(4Z)-4-[[4-(4-fluorophenyl)piperazin-1-yl]-sulfanyl-methylidene]-2-methoxy-cyclohexa-2,5-dien-1-one

Systemtic Name: (4Z)-4-[[4-(4-fluorophenyl)piperazin-1-yl]-sulfanyl-methylidene]-2-methoxy-cyclohexa-2,5-dien-1-one Openeye Name: (4Z)-4-[[4-(4-fluorophenyl)piperazin-1-yl]-sulfanyl-methylene]-2-methoxy-cyclohexa-2,5-dien-1-one CAS Name: (4Z)-4-[[4-(4-fluorophenyl)-1-piperazinyl]-mercaptomethylidene]-2-methoxy-1-cyclohexa-2,5-dienone IUPAC Name: (4Z)-4-[[4-(4-fluorophenyl)piperazin-1-yl]-sulfanylmethylidene]-2-methoxycyclohexa-2,5-dien-1-one Traditional Name: (4Z)-4-[[4-(4-fluorophenyl)piperazino]-mercapto-methylene]-2-methoxy-cyclohexa-2,5-dien-1-one Formula: C18H19FN2O2S MolecularWeight: 346.419063

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(N2CCN(CC2)C3=CC=C(C=C3)F)S)C=CC1=O

Isomeric SMILES

COC1=C/C(=C(/N2CCN(CC2)C3=CC=C(C=C3)F)\S)/C=CC1=O

InChI

InChI=1S/C18H19FN2O2S/c1-23-17-12-13(2-7-16(17)22)18(24)21-10-8-20(9-11-21)15-5-3-14(19)4-6-15/h2-7,12,24H,8-11H2,1H3/b18-13-