1-[(4-methyl-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-N-phenyl-piperidine-4-carboxamide

Systemtic Name: 1-[(4-methyl-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-N-phenyl-piperidine-4-carboxamide Openeye Name: 1-[[4-methyl-3-(4-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]-N-phenyl-piperidine-4-carboxamide CAS Name: 1-[(4-methyl-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-N-phenyl-4-piperidinecarboxamide IUPAC Name: 1-[(4-methyl-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-N-phenylpiperidine-4-carboxamide Traditional Name: 1-[[4-methyl-3-(4-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]-N-phenyl-isonipecotamide Formula: C21H24N6OS MolecularWeight: 408.51986

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)CN2CCC(CC2)C(=O)NC3=CC=CC=C3)C4=CC=NC=C4

Isomeric SMILES

CN1C(=NN(C1=S)CN2CCC(CC2)C(=O)NC3=CC=CC=C3)C4=CC=NC=C4

InChI

InChI=1S/C21H24N6OS/c1-25-19(16-7-11-22-12-8-16)24-27(21(25)29)15-26-13-9-17(10-14-26)20(28)23-18-5-3-2-4-6-18/h2-8,11-12,17H,9-10,13-15H2,1H3,(H,23,28)