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

Systemtic Name: 1-(3-chlorophenyl)-3-(4-cyclopropyl-2-ethyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl)urea Openeye Name: 1-(3-chlorophenyl)-3-(4-cyclopropyl-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl)urea CAS Name: 1-(3-chlorophenyl)-3-(4-cyclopropyl-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl)urea IUPAC Name: 1-(3-chlorophenyl)-3-(4-cyclopropyl-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl)urea Traditional Name: 1-(3-chlorophenyl)-3-(4-cyclopropyl-2-ethyl-3-keto-5H-1,4-benzoxazepin-7-yl)urea Formula: C21H22ClN3O3 MolecularWeight: 399.87068

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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)C4CC4

Isomeric SMILES

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)NC3=CC(=CC=C3)Cl)C4CC4

InChI

InChI=1S/C21H22ClN3O3/c1-2-18-20(26)25(17-7-8-17)12-13-10-16(6-9-19(13)28-18)24-21(27)23-15-5-3-4-14(22)11-15/h3-6,9-11,17-18H,2,7-8,12H2,1H3,(H2,23,24,27)