1-(1-azido-1-oxidanylidene-heptan-3-yl)-3-pyridin-2-yl-urea

Systemtic Name: 1-(1-azido-1-oxidanylidene-heptan-3-yl)-3-pyridin-2-yl-urea Openeye Name: 3-(2-pyridylcarbamoylamino)heptanoyl azide CAS Name: 1-(1-azido-1-oxoheptan-3-yl)-3-(2-pyridinyl)urea IUPAC Name: 3-(pyridin-2-ylcarbamoylamino)heptanoyl azide Traditional Name: 1-[1-(2-azido-2-keto-ethyl)pentyl]-3-(2-pyridyl)urea Formula: C13H18N6O2 MolecularWeight: 290.32102

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(=O)N=[N+]=[N-])NC(=O)NC1=CC=CC=N1

Isomeric SMILES

CCCCC(CC(=O)N=[N+]=[N-])NC(=O)NC1=CC=CC=N1

InChI

InChI=1S/C13H18N6O2/c1-2-3-6-10(9-12(20)18-19-14)16-13(21)17-11-7-4-5-8-15-11/h4-5,7-8,10H,2-3,6,9H2,1H3,(H2,15,16,17,21)