N-(2-cyanophenyl)-2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(2-cyanophenyl)-2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(2-cyanophenyl)-2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2-cyanophenyl)-2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2-cyanophenyl)-2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(2-cyanophenyl)-2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C18H15N5OS MolecularWeight: 349.4096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=NN=C2SCC(=O)NC3=CC=CC=C3C#N

Isomeric SMILES

CC1=CC=CC=C1N2C=NN=C2SCC(=O)NC3=CC=CC=C3C#N

InChI

InChI=1S/C18H15N5OS/c1-13-6-2-5-9-16(13)23-12-20-22-18(23)25-11-17(24)21-15-8-4-3-7-14(15)10-19/h2-9,12H,11H2,1H3,(H,21,24)