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

Systemtic Name: 1-[(4-ethyl-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperidine-4-carboxamide Openeye Name: 1-[[4-ethyl-3-(4-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]piperidine-4-carboxamide CAS Name: 1-[(4-ethyl-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-[(4-ethyl-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperidine-4-carboxamide Traditional Name: 1-[[4-ethyl-3-(4-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]isonipecotamide Formula: C16H22N6OS MolecularWeight: 346.45048

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)CN2CCC(CC2)C(=O)N)C3=CC=NC=C3

Isomeric SMILES

CCN1C(=NN(C1=S)CN2CCC(CC2)C(=O)N)C3=CC=NC=C3

InChI

InChI=1S/C16H22N6OS/c1-2-21-15(13-3-7-18-8-4-13)19-22(16(21)24)11-20-9-5-12(6-10-20)14(17)23/h3-4,7-8,12H,2,5-6,9-11H2,1H3,(H2,17,23)