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

Systemtic Name: 1-(2-oxidanylideneazepan-3-yl)-3-quinolin-3-yl-urea Openeye Name: 1-(2-oxoazepan-3-yl)-3-(3-quinolyl)urea CAS Name: 1-(2-oxo-3-azepanyl)-3-(3-quinolinyl)urea IUPAC Name: 1-(2-oxoazepan-3-yl)-3-quinolin-3-ylurea Traditional Name: 1-(2-ketoazepan-3-yl)-3-(3-quinolyl)urea Formula: C16H18N4O2 MolecularWeight: 298.33972

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC(=O)NC2=CC3=CC=CC=C3N=C2

Isomeric SMILES

C1CCNC(=O)C(C1)NC(=O)NC2=CC3=CC=CC=C3N=C2

InChI

InChI=1S/C16H18N4O2/c21-15-14(7-3-4-8-17-15)20-16(22)19-12-9-11-5-1-2-6-13(11)18-10-12/h1-2,5-6,9-10,14H,3-4,7-8H2,(H,17,21)(H2,19,20,22)