1-cyclohexyl-1-methyl-3-[[2-(1,2,4-triazol-1-yl)pyridin-3-yl]methyl]urea

Systemtic Name: 1-cyclohexyl-1-methyl-3-[[2-(1,2,4-triazol-1-yl)pyridin-3-yl]methyl]urea Openeye Name: 1-cyclohexyl-1-methyl-3-[[2-(1,2,4-triazol-1-yl)-3-pyridyl]methyl]urea CAS Name: 1-cyclohexyl-1-methyl-3-[[2-(1,2,4-triazol-1-yl)-3-pyridinyl]methyl]urea IUPAC Name: 1-cyclohexyl-1-methyl-3-[[2-(1,2,4-triazol-1-yl)pyridin-3-yl]methyl]urea Traditional Name: 1-cyclohexyl-1-methyl-3-[[2-(1,2,4-triazol-1-yl)-3-pyridyl]methyl]urea Formula: C16H22N6O MolecularWeight: 314.38548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)NCC2=C(N=CC=C2)N3C=NC=N3

Isomeric SMILES

CN(C1CCCCC1)C(=O)NCC2=C(N=CC=C2)N3C=NC=N3

InChI

InChI=1S/C16H22N6O/c1-21(14-7-3-2-4-8-14)16(23)19-10-13-6-5-9-18-15(13)22-12-17-11-20-22/h5-6,9,11-12,14H,2-4,7-8,10H2,1H3,(H,19,23)