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

Systemtic Name: 1-[4-[(2-chlorophenyl)methyl]-2-ethyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-3-(4-propan-2-ylphenyl)urea Openeye Name: 1-[4-[(2-chlorophenyl)methyl]-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-3-(4-isopropylphenyl)urea CAS Name: 1-[4-[(2-chlorophenyl)methyl]-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-3-(4-propan-2-ylphenyl)urea IUPAC Name: 1-[4-[(2-chlorophenyl)methyl]-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-3-(4-propan-2-ylphenyl)urea Traditional Name: 1-[4-(2-chlorobenzyl)-2-ethyl-3-keto-5H-1,4-benzoxazepin-7-yl]-3-p-cumenyl-urea Formula: C28H30ClN3O3 MolecularWeight: 492.0091

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)NC3=CC=C(C=C3)C(C)C)CC4=CC=CC=C4Cl

Isomeric SMILES

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)NC3=CC=C(C=C3)C(C)C)CC4=CC=CC=C4Cl

InChI

InChI=1S/C28H30ClN3O3/c1-4-25-27(33)32(16-20-7-5-6-8-24(20)29)17-21-15-23(13-14-26(21)35-25)31-28(34)30-22-11-9-19(10-12-22)18(2)3/h5-15,18,25H,4,16-17H2,1-3H3,(H2,30,31,34)