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

Systemtic Name: N-(3-ethanoylphenyl)-2-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-(3-acetylphenyl)-2-[[5-(p-tolyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-(3-acetylphenyl)-2-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(3-acetylphenyl)-2-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-(3-acetylphenyl)-2-[[5-(p-tolyl)-1H-1,2,4-triazol-3-yl]thio]propionamide Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NN2)SC(C)C(=O)NC3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NN2)SC(C)C(=O)NC3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C20H20N4O2S/c1-12-7-9-15(10-8-12)18-22-20(24-23-18)27-14(3)19(26)21-17-6-4-5-16(11-17)13(2)25/h4-11,14H,1-3H3,(H,21,26)(H,22,23,24)