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

Systemtic Name: 1-[2-ethyl-4-(2-methylpropyl)-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-3-phenyl-urea Openeye Name: 1-(2-ethyl-4-isobutyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-3-phenyl-urea CAS Name: 1-[2-ethyl-4-(2-methylpropyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]-3-phenylurea IUPAC Name: 1-[2-ethyl-4-(2-methylpropyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]-3-phenylurea Traditional Name: 1-(2-ethyl-4-isobutyl-3-keto-5H-1,4-benzoxazepin-7-yl)-3-phenyl-urea Formula: C22H27N3O3 MolecularWeight: 381.46808

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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)CC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O3/c1-4-19-21(26)25(13-15(2)3)14-16-12-18(10-11-20(16)28-19)24-22(27)23-17-8-6-5-7-9-17/h5-12,15,19H,4,13-14H2,1-3H3,(H2,23,24,27)