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

Systemtic Name: 1-(3-chlorophenyl)-3-[2-methyl-3-oxidanylidene-4-(phenylmethyl)-5H-1,4-benzoxazepin-7-yl]urea Openeye Name: 1-(4-benzyl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-3-(3-chlorophenyl)urea CAS Name: 1-(3-chlorophenyl)-3-[2-methyl-3-oxo-4-(phenylmethyl)-5H-1,4-benzoxazepin-7-yl]urea IUPAC Name: 1-(4-benzyl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-3-(3-chlorophenyl)urea Traditional Name: 1-(4-benzyl-3-keto-2-methyl-5H-1,4-benzoxazepin-7-yl)-3-(3-chlorophenyl)urea Formula: C24H22ClN3O3 MolecularWeight: 435.90278

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)NC3=CC(=CC=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)NC3=CC(=CC=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C24H22ClN3O3/c1-16-23(29)28(14-17-6-3-2-4-7-17)15-18-12-21(10-11-22(18)31-16)27-24(30)26-20-9-5-8-19(25)13-20/h2-13,16H,14-15H2,1H3,(H2,26,27,30)