1-(4-cyclohexyl-2-ethyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl)-3-(phenylmethyl)urea

Systemtic Name: 1-(4-cyclohexyl-2-ethyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl)-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-(4-cyclohexyl-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl)urea CAS Name: 1-(4-cyclohexyl-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-(4-cyclohexyl-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl)urea Traditional Name: 1-benzyl-3-(4-cyclohexyl-2-ethyl-3-keto-5H-1,4-benzoxazepin-7-yl)urea Formula: C25H31N3O3 MolecularWeight: 421.53194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)NCC3=CC=CC=C3)C4CCCCC4

Isomeric SMILES

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)NCC3=CC=CC=C3)C4CCCCC4

InChI

InChI=1S/C25H31N3O3/c1-2-22-24(29)28(21-11-7-4-8-12-21)17-19-15-20(13-14-23(19)31-22)27-25(30)26-16-18-9-5-3-6-10-18/h3,5-6,9-10,13-15,21-22H,2,4,7-8,11-12,16-17H2,1H3,(H2,26,27,30)