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

Systemtic Name: 4-[[4-(diphenylmethyl)piperazin-1-yl]-sulfanyl-methylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[(4-benzhydrylpiperazin-1-yl)-sulfanyl-methylene]cyclohexa-2,5-dien-1-one CAS Name: 4-[[4-(diphenylmethyl)-1-piperazinyl]-mercaptomethylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[(4-benzhydrylpiperazin-1-yl)-sulfanylmethylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[(4-benzhydrylpiperazino)-mercapto-methylene]cyclohexa-2,5-dien-1-one Formula: C24H24N2OS MolecularWeight: 388.52516

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=C4C=CC(=O)C=C4)S

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=C4C=CC(=O)C=C4)S

InChI

InChI=1S/C24H24N2OS/c27-22-13-11-21(12-14-22)24(28)26-17-15-25(16-18-26)23(19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-14,23,28H,15-18H2