(2S)-2-[[4-(2-methoxyphenyl)-5-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylphenyl)propanamide

Systemtic Name: (2S)-2-[[4-(2-methoxyphenyl)-5-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylphenyl)propanamide Openeye Name: (2S)-2-[[4-(2-methoxyphenyl)-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(o-tolyl)propanamide CAS Name: (2S)-2-[[4-(2-methoxyphenyl)-5-(6-oxo-1-cyclohexa-2,4-dienylidene)-1H-1,2,4-triazol-3-yl]thio]-N-(2-methylphenyl)propanamide IUPAC Name: (2S)-2-[[4-(2-methoxyphenyl)-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylphenyl)propanamide Traditional Name: (2S)-2-[[5-(6-ketocyclohexa-2,4-dien-1-ylidene)-4-(2-methoxyphenyl)-1H-1,2,4-triazol-3-yl]thio]-N-(o-tolyl)propionamide Formula: C25H24N4O3S MolecularWeight: 460.54806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(C)SC2=NNC(=C3C=CC=CC3=O)N2C4=CC=CC=C4OC

Isomeric SMILES

CC1=CC=CC=C1NC(=O)[C@H](C)SC2=NNC(=C3C=CC=CC3=O)N2C4=CC=CC=C4OC

InChI

InChI=1S/C25H24N4O3S/c1-16-10-4-6-12-19(16)26-24(31)17(2)33-25-28-27-23(18-11-5-8-14-21(18)30)29(25)20-13-7-9-15-22(20)32-3/h4-15,17,27H,1-3H3,(H,26,31)/t17-/m0/s1