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

Systemtic Name: 1-(3-chlorophenyl)-3-[2-ethyl-3-oxidanylidene-4-(1-phenylpropyl)-5H-1,4-benzoxazepin-7-yl]urea Openeye Name: 1-(3-chlorophenyl)-3-[2-ethyl-3-oxo-4-(1-phenylpropyl)-5H-1,4-benzoxazepin-7-yl]urea CAS Name: 1-(3-chlorophenyl)-3-[2-ethyl-3-oxo-4-(1-phenylpropyl)-5H-1,4-benzoxazepin-7-yl]urea IUPAC Name: 1-(3-chlorophenyl)-3-[2-ethyl-3-oxo-4-(1-phenylpropyl)-5H-1,4-benzoxazepin-7-yl]urea Traditional Name: 1-(3-chlorophenyl)-3-[2-ethyl-3-keto-4-(1-phenylpropyl)-5H-1,4-benzoxazepin-7-yl]urea Formula: C27H28ClN3O3 MolecularWeight: 477.98252

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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)C(CC)C4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C27H28ClN3O3/c1-3-23(18-9-6-5-7-10-18)31-17-19-15-22(13-14-25(19)34-24(4-2)26(31)32)30-27(33)29-21-12-8-11-20(28)16-21/h5-16,23-24H,3-4,17H2,1-2H3,(H2,29,30,33)