N-propan-2-yl-1-[4-(2-pyridin-2-ylsulfanylethanoylamino)cyclohexyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: N-propan-2-yl-1-[4-(2-pyridin-2-ylsulfanylethanoylamino)cyclohexyl]-1,2,3-triazole-4-carboxamide Openeye Name: N-isopropyl-1-[4-[[2-(2-pyridylsulfanyl)acetyl]amino]cyclohexyl]triazole-4-carboxamide CAS Name: 1-[4-[[1-oxo-2-(2-pyridinylthio)ethyl]amino]cyclohexyl]-N-propan-2-yl-4-triazolecarboxamide IUPAC Name: N-propan-2-yl-1-[4-[(2-pyridin-2-ylsulfanylacetyl)amino]cyclohexyl]triazole-4-carboxamide Traditional Name: N-isopropyl-1-[4-[[2-(2-pyridylthio)acetyl]amino]cyclohexyl]triazole-4-carboxamide Formula: C19H26N6O2S MolecularWeight: 402.51374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CN(N=N1)C2CCC(CC2)NC(=O)CSC3=CC=CC=N3

Isomeric SMILES

CC(C)NC(=O)C1=CN(N=N1)C2CCC(CC2)NC(=O)CSC3=CC=CC=N3

InChI

InChI=1S/C19H26N6O2S/c1-13(2)21-19(27)16-11-25(24-23-16)15-8-6-14(7-9-15)22-17(26)12-28-18-5-3-4-10-20-18/h3-5,10-11,13-15H,6-9,12H2,1-2H3,(H,21,27)(H,22,26)