N-[[6-(azepan-1-yl)pyridin-3-yl]methyl]-2-(1,2,4-triazol-1-yl)propanamide

Systemtic Name: N-[[6-(azepan-1-yl)pyridin-3-yl]methyl]-2-(1,2,4-triazol-1-yl)propanamide Openeye Name: N-[[6-(azepan-1-yl)-3-pyridyl]methyl]-2-(1,2,4-triazol-1-yl)propanamide CAS Name: N-[[6-(1-azepanyl)-3-pyridinyl]methyl]-2-(1,2,4-triazol-1-yl)propanamide IUPAC Name: N-[[6-(azepan-1-yl)pyridin-3-yl]methyl]-2-(1,2,4-triazol-1-yl)propanamide Traditional Name: N-[[6-(azepan-1-yl)-3-pyridyl]methyl]-2-(1,2,4-triazol-1-yl)propionamide Formula: C17H24N6O MolecularWeight: 328.41206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CN=C(C=C1)N2CCCCCC2)N3C=NC=N3

Isomeric SMILES

CC(C(=O)NCC1=CN=C(C=C1)N2CCCCCC2)N3C=NC=N3

InChI

InChI=1S/C17H24N6O/c1-14(23-13-18-12-21-23)17(24)20-11-15-6-7-16(19-10-15)22-8-4-2-3-5-9-22/h6-7,10,12-14H,2-5,8-9,11H2,1H3,(H,20,24)