N-(2-methoxyphenyl)-4-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-3-oxidanylidene-butanamide

Systemtic Name: N-(2-methoxyphenyl)-4-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-3-oxidanylidene-butanamide Openeye Name: N-(2-methoxyphenyl)-4-[[4-methyl-5-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-3-oxo-butanamide CAS Name: N-(2-methoxyphenyl)-4-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]-3-oxobutanamide IUPAC Name: N-(2-methoxyphenyl)-4-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-3-oxobutanamide Traditional Name: 3-keto-N-(2-methoxyphenyl)-4-[[4-methyl-5-(p-tolyl)-1,2,4-triazol-3-yl]thio]butyramide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2C)SCC(=O)CC(=O)NC3=CC=CC=C3OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2C)SCC(=O)CC(=O)NC3=CC=CC=C3OC

InChI

InChI=1S/C21H22N4O3S/c1-14-8-10-15(11-9-14)20-23-24-21(25(20)2)29-13-16(26)12-19(27)22-17-6-4-5-7-18(17)28-3/h4-11H,12-13H2,1-3H3,(H,22,27)