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

Systemtic Name: 1-(3-chlorophenyl)-3-[2-ethyl-4-(2-methylpropyl)-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]urea Openeye Name: 1-(3-chlorophenyl)-3-(2-ethyl-4-isobutyl-3-oxo-5H-1,4-benzoxazepin-7-yl)urea CAS Name: 1-(3-chlorophenyl)-3-[2-ethyl-4-(2-methylpropyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]urea IUPAC Name: 1-(3-chlorophenyl)-3-[2-ethyl-4-(2-methylpropyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]urea Traditional Name: 1-(3-chlorophenyl)-3-(2-ethyl-4-isobutyl-3-keto-5H-1,4-benzoxazepin-7-yl)urea Formula: C22H26ClN3O3 MolecularWeight: 415.91314

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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)CC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C22H26ClN3O3/c1-4-19-21(27)26(12-14(2)3)13-15-10-18(8-9-20(15)29-19)25-22(28)24-17-7-5-6-16(23)11-17/h5-11,14,19H,4,12-13H2,1-3H3,(H2,24,25,28)