N-[[4-(2-methylpropyl)-5-(pyridin-4-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]cyclobutanecarboxamide

Systemtic Name: N-[[4-(2-methylpropyl)-5-(pyridin-4-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]cyclobutanecarboxamide Openeye Name: N-[[4-isobutyl-5-(4-pyridylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]cyclobutanecarboxamide CAS Name: N-[[4-(2-methylpropyl)-5-(pyridin-4-ylmethylthio)-1,2,4-triazol-3-yl]methyl]cyclobutanecarboxamide IUPAC Name: N-[[4-(2-methylpropyl)-5-(pyridin-4-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]cyclobutanecarboxamide Traditional Name: N-[[4-isobutyl-5-(4-pyridylmethylthio)-1,2,4-triazol-3-yl]methyl]cyclobutanecarboxamide Formula: C18H25N5OS MolecularWeight: 359.489

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NN=C1SCC2=CC=NC=C2)CNC(=O)C3CCC3

Isomeric SMILES

CC(C)CN1C(=NN=C1SCC2=CC=NC=C2)CNC(=O)C3CCC3

InChI

InChI=1S/C18H25N5OS/c1-13(2)11-23-16(10-20-17(24)15-4-3-5-15)21-22-18(23)25-12-14-6-8-19-9-7-14/h6-9,13,15H,3-5,10-12H2,1-2H3,(H,20,24)