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

Systemtic Name: 1-[2-ethyl-3-oxidanylidene-4-(1-phenylpropyl)-5H-1,4-benzoxazepin-7-yl]-3-phenyl-urea Openeye Name: 1-[2-ethyl-3-oxo-4-(1-phenylpropyl)-5H-1,4-benzoxazepin-7-yl]-3-phenyl-urea CAS Name: 1-[2-ethyl-3-oxo-4-(1-phenylpropyl)-5H-1,4-benzoxazepin-7-yl]-3-phenylurea IUPAC Name: 1-[2-ethyl-3-oxo-4-(1-phenylpropyl)-5H-1,4-benzoxazepin-7-yl]-3-phenylurea Traditional Name: 1-[2-ethyl-3-keto-4-(1-phenylpropyl)-5H-1,4-benzoxazepin-7-yl]-3-phenyl-urea Formula: C27H29N3O3 MolecularWeight: 443.53746

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

Isomeric SMILES

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

InChI

InChI=1S/C27H29N3O3/c1-3-23(19-11-7-5-8-12-19)30-18-20-17-22(15-16-25(20)33-24(4-2)26(30)31)29-27(32)28-21-13-9-6-10-14-21/h5-17,23-24H,3-4,18H2,1-2H3,(H2,28,29,32)