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

Systemtic Name: N-[[2-(1,2,4-triazol-1-yl)pyridin-3-yl]methyl]azepane-1-sulfonamide Openeye Name: N-[[2-(1,2,4-triazol-1-yl)-3-pyridyl]methyl]azepane-1-sulfonamide CAS Name: N-[[2-(1,2,4-triazol-1-yl)-3-pyridinyl]methyl]-1-azepanesulfonamide IUPAC Name: N-[[2-(1,2,4-triazol-1-yl)pyridin-3-yl]methyl]azepane-1-sulfonamide Traditional Name: N-[[2-(1,2,4-triazol-1-yl)-3-pyridyl]methyl]azepane-1-sulfonamide Formula: C14H20N6O2S MolecularWeight: 336.4126

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)NCC2=C(N=CC=C2)N3C=NC=N3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)NCC2=C(N=CC=C2)N3C=NC=N3

InChI

InChI=1S/C14H20N6O2S/c21-23(22,19-8-3-1-2-4-9-19)18-10-13-6-5-7-16-14(13)20-12-15-11-17-20/h5-7,11-12,18H,1-4,8-10H2