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

Systemtic Name: 1-[(4-cyclopropyl-3-pyridin-3-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-N-(1,3-thiazol-2-yl)piperidine-3-carboxamide Openeye Name: 1-[[4-cyclopropyl-3-(3-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]-N-thiazol-2-yl-piperidine-3-carboxamide CAS Name: 1-[[4-cyclopropyl-3-(3-pyridinyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-N-(2-thiazolyl)-3-piperidinecarboxamide IUPAC Name: 1-[(4-cyclopropyl-3-pyridin-3-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-N-(1,3-thiazol-2-yl)piperidine-3-carboxamide Traditional Name: 1-[[4-cyclopropyl-3-(3-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]-N-thiazol-2-yl-nipecotamide Formula: C20H23N7OS2 MolecularWeight: 441.57292

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CN2C(=S)N(C(=N2)C3=CN=CC=C3)C4CC4)C(=O)NC5=NC=CS5

Isomeric SMILES

C1CC(CN(C1)CN2C(=S)N(C(=N2)C3=CN=CC=C3)C4CC4)C(=O)NC5=NC=CS5

InChI

InChI=1S/C20H23N7OS2/c28-18(23-19-22-8-10-30-19)15-4-2-9-25(12-15)13-26-20(29)27(16-5-6-16)17(24-26)14-3-1-7-21-11-14/h1,3,7-8,10-11,15-16H,2,4-6,9,12-13H2,(H,22,23,28)