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

Systemtic Name: N-[[6-(1,2,4-triazol-1-yl)pyridin-3-yl]methyl]azepane-1-carboxamide Openeye Name: N-[[6-(1,2,4-triazol-1-yl)-3-pyridyl]methyl]azepane-1-carboxamide CAS Name: N-[[6-(1,2,4-triazol-1-yl)-3-pyridinyl]methyl]-1-azepanecarboxamide IUPAC Name: N-[[6-(1,2,4-triazol-1-yl)pyridin-3-yl]methyl]azepane-1-carboxamide Traditional Name: N-[[6-(1,2,4-triazol-1-yl)-3-pyridyl]methyl]azepane-1-carboxamide Formula: C15H20N6O MolecularWeight: 300.3589

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)NCC2=CN=C(C=C2)N3C=NC=N3

Isomeric SMILES

C1CCCN(CC1)C(=O)NCC2=CN=C(C=C2)N3C=NC=N3

InChI

InChI=1S/C15H20N6O/c22-15(20-7-3-1-2-4-8-20)18-10-13-5-6-14(17-9-13)21-12-16-11-19-21/h5-6,9,11-12H,1-4,7-8,10H2,(H,18,22)