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

Systemtic Name: N-(4-ethanoylphenyl)-2-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]butanamide Openeye Name: N-(4-acetylphenyl)-2-[[4-methyl-5-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]butanamide CAS Name: N-(4-acetylphenyl)-2-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]butanamide IUPAC Name: N-(4-acetylphenyl)-2-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]butanamide Traditional Name: N-(4-acetylphenyl)-2-[[4-methyl-5-(p-tolyl)-1,2,4-triazol-3-yl]thio]butyramide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)C(=O)C)SC2=NN=C(N2C)C3=CC=C(C=C3)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)C(=O)C)SC2=NN=C(N2C)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H24N4O2S/c1-5-19(21(28)23-18-12-10-16(11-13-18)15(3)27)29-22-25-24-20(26(22)4)17-8-6-14(2)7-9-17/h6-13,19H,5H2,1-4H3,(H,23,28)