1-[[5-(4-ethylphenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl]-N-(6-methylpyridin-2-yl)piperidine-4-carboxamide

Systemtic Name: 1-[[5-(4-ethylphenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl]-N-(6-methylpyridin-2-yl)piperidine-4-carboxamide Openeye Name: 1-[[5-(4-ethylphenyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl]-N-(6-methyl-2-pyridyl)piperidine-4-carboxamide CAS Name: 1-[[5-(4-ethylphenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl]-N-(6-methyl-2-pyridinyl)-4-piperidinecarboxamide IUPAC Name: 1-[[5-(4-ethylphenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl]-N-(6-methylpyridin-2-yl)piperidine-4-carboxamide Traditional Name: 1-[[5-(4-ethylphenyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl]-N-(6-methyl-2-pyridyl)isonipecotamide Formula: C23H28N6OS MolecularWeight: 436.57302

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=S)N(N2)CN3CCC(CC3)C(=O)NC4=CC=CC(=N4)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=S)N(N2)CN3CCC(CC3)C(=O)NC4=CC=CC(=N4)C

InChI

InChI=1S/C23H28N6OS/c1-3-17-7-9-18(10-8-17)21-26-23(31)29(27-21)15-28-13-11-19(12-14-28)22(30)25-20-6-4-5-16(2)24-20/h4-10,19H,3,11-15H2,1-2H3,(H,24,25,30)(H,26,27,31)