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

Systemtic Name: 2-[[4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-quinolin-3-yl-ethanamide Openeye Name: 2-[[4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-quinolyl)acetamide CAS Name: 2-[[4-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]-N-(3-quinolinyl)acetamide IUPAC Name: 2-[[4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-quinolin-3-ylacetamide Traditional Name: 2-[[4-(p-tolyl)-1,2,4-triazol-3-yl]thio]-N-(3-quinolyl)acetamide Formula: C20H17N5OS MolecularWeight: 375.44688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=NN=C2SCC(=O)NC3=CC4=CC=CC=C4N=C3

Isomeric SMILES

CC1=CC=C(C=C1)N2C=NN=C2SCC(=O)NC3=CC4=CC=CC=C4N=C3

InChI

InChI=1S/C20H17N5OS/c1-14-6-8-17(9-7-14)25-13-22-24-20(25)27-12-19(26)23-16-10-15-4-2-3-5-18(15)21-11-16/h2-11,13H,12H2,1H3,(H,23,26)