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

Systemtic Name: 6-[3-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-phenethyl-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[3-[2-oxo-2-(p-tolyl)ethyl]sulfanyl-4-phenethyl-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[3-[[2-(4-methylphenyl)-2-oxoethyl]thio]-4-phenethyl-1H-1,2,4-triazol-5-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[3-[2-(4-methylphenyl)-2-oxoethyl]sulfanyl-4-phenethyl-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[3-[[2-keto-2-(p-tolyl)ethyl]thio]-4-phenethyl-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one Formula: C25H23N3O2S MolecularWeight: 429.53402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=NNC(=C3C=CC=CC3=O)N2CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=NNC(=C3C=CC=CC3=O)N2CCC4=CC=CC=C4

InChI

InChI=1S/C25H23N3O2S/c1-18-11-13-20(14-12-18)23(30)17-31-25-27-26-24(21-9-5-6-10-22(21)29)28(25)16-15-19-7-3-2-4-8-19/h2-14,26H,15-17H2,1H3