2-[4-[[4-(4-methylphenyl)-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-[[4-(4-methylphenyl)-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-2-[4-[[4-(p-tolyl)-3-(4-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]acetamide CAS Name: 2-[4-[[4-(4-methylphenyl)-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-1-piperazinyl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-[[4-(4-methylphenyl)-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[4-[[4-(p-tolyl)-3-(4-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]piperazino]acetamide Formula: C24H31N7OS MolecularWeight: 465.61424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN(C2=S)CN3CCN(CC3)CC(=O)NC(C)C)C4=CC=NC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN(C2=S)CN3CCN(CC3)CC(=O)NC(C)C)C4=CC=NC=C4

InChI

InChI=1S/C24H31N7OS/c1-18(2)26-22(32)16-28-12-14-29(15-13-28)17-30-24(33)31(21-6-4-19(3)5-7-21)23(27-30)20-8-10-25-11-9-20/h4-11,18H,12-17H2,1-3H3,(H,26,32)