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

Systemtic Name: 1-(3-chlorophenyl)-3-[2-ethyl-3-oxidanylidene-4-(phenylmethyl)-5H-1,4-benzoxazepin-7-yl]urea Openeye Name: 1-(4-benzyl-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-3-(3-chlorophenyl)urea CAS Name: 1-(3-chlorophenyl)-3-[2-ethyl-3-oxo-4-(phenylmethyl)-5H-1,4-benzoxazepin-7-yl]urea IUPAC Name: 1-(4-benzyl-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-3-(3-chlorophenyl)urea Traditional Name: 1-(4-benzyl-2-ethyl-3-keto-5H-1,4-benzoxazepin-7-yl)-3-(3-chlorophenyl)urea Formula: C25H24ClN3O3 MolecularWeight: 449.92936

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)NC3=CC(=CC=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)NC3=CC(=CC=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C25H24ClN3O3/c1-2-22-24(30)29(15-17-7-4-3-5-8-17)16-18-13-21(11-12-23(18)32-22)28-25(31)27-20-10-6-9-19(26)14-20/h3-14,22H,2,15-16H2,1H3,(H2,27,28,31)