2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(2-methyl-2-piperidin-1-yl-propyl)ethanamide

Systemtic Name: 2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(2-methyl-2-piperidin-1-yl-propyl)ethanamide Openeye Name: N-[2-methyl-2-(1-piperidyl)propyl]-2-[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: 2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[2-methyl-2-(1-piperidinyl)propyl]acetamide IUPAC Name: 2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(2-methyl-2-piperidin-1-ylpropyl)acetamide Traditional Name: N-(2-methyl-2-piperidino-propyl)-2-[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C20H29N5OS MolecularWeight: 387.54216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=S)N2CC(=O)NCC(C)(C)N3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=S)N2CC(=O)NCC(C)(C)N3CCCCC3

InChI

InChI=1S/C20H29N5OS/c1-15-7-9-16(10-8-15)18-22-23-19(27)25(18)13-17(26)21-14-20(2,3)24-11-5-4-6-12-24/h7-10H,4-6,11-14H2,1-3H3,(H,21,26)(H,23,27)