4-[(4-phenylpiperazin-1-yl)-sulfanyl-methylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[(4-phenylpiperazin-1-yl)-sulfanyl-methylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[(4-phenylpiperazin-1-yl)-sulfanyl-methylene]cyclohexa-2,5-dien-1-one CAS Name: 4-[mercapto-(4-phenyl-1-piperazinyl)methylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[(4-phenylpiperazin-1-yl)-sulfanylmethylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[mercapto-(4-phenylpiperazino)methylene]cyclohexa-2,5-dien-1-one Formula: C17H18N2OS MolecularWeight: 298.40262

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=C3C=CC(=O)C=C3)S

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=C3C=CC(=O)C=C3)S

InChI

InChI=1S/C17H18N2OS/c20-16-8-6-14(7-9-16)17(21)19-12-10-18(11-13-19)15-4-2-1-3-5-15/h1-9,21H,10-13H2