1-(2-oxidanylideneazepan-3-yl)-3-pyridin-3-yl-urea

Systemtic Name: 1-(2-oxidanylideneazepan-3-yl)-3-pyridin-3-yl-urea Openeye Name: 1-(2-oxoazepan-3-yl)-3-(3-pyridyl)urea CAS Name: 1-(2-oxo-3-azepanyl)-3-(3-pyridinyl)urea IUPAC Name: 1-(2-oxoazepan-3-yl)-3-pyridin-3-ylurea Traditional Name: 1-(2-ketoazepan-3-yl)-3-(3-pyridyl)urea Formula: C12H16N4O2 MolecularWeight: 248.28104

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC(=O)NC2=CN=CC=C2

Isomeric SMILES

C1CCNC(=O)C(C1)NC(=O)NC2=CN=CC=C2

InChI

InChI=1S/C12H16N4O2/c17-11-10(5-1-2-7-14-11)16-12(18)15-9-4-3-6-13-8-9/h3-4,6,8,10H,1-2,5,7H2,(H,14,17)(H2,15,16,18)