6-[3-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-4-phenyl-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[3-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-4-phenyl-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-4-phenyl-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[3-[[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]thio]-4-phenyl-1H-1,2,4-triazol-5-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-4-phenyl-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[3-[[2-keto-2-(4-phenylpiperazino)ethyl]thio]-4-phenyl-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one Formula: C26H25N5O2S MolecularWeight: 471.574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CSC3=NNC(=C4C=CC=CC4=O)N3C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CSC3=NNC(=C4C=CC=CC4=O)N3C5=CC=CC=C5

InChI

InChI=1S/C26H25N5O2S/c32-23-14-8-7-13-22(23)25-27-28-26(31(25)21-11-5-2-6-12-21)34-19-24(33)30-17-15-29(16-18-30)20-9-3-1-4-10-20/h1-14,27H,15-19H2