(6Z)-6-[[4-(3-nitrophenyl)piperazin-1-yl]-sulfanyl-methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-6-[[4-(3-nitrophenyl)piperazin-1-yl]-sulfanyl-methylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-6-[[4-(3-nitrophenyl)piperazin-1-yl]-sulfanyl-methylene]cyclohexa-2,4-dien-1-one CAS Name: (6Z)-6-[mercapto-[4-(3-nitrophenyl)-1-piperazinyl]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-6-[[4-(3-nitrophenyl)piperazin-1-yl]-sulfanylmethylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6Z)-6-[mercapto-[4-(3-nitrophenyl)piperazino]methylene]cyclohexa-2,4-dien-1-one Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)[N+](=O)[O-])C(=C3C=CC=CC3=O)S

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)[N+](=O)[O-])/C(=C/3\C=CC=CC3=O)/S

InChI

InChI=1S/C17H17N3O3S/c21-16-7-2-1-6-15(16)17(24)19-10-8-18(9-11-19)13-4-3-5-14(12-13)20(22)23/h1-7,12,24H,8-11H2/b17-15-