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

Systemtic Name: 1-[4-[(2-chlorophenyl)methyl]-2-ethyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[4-[(2-chlorophenyl)methyl]-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl]urea CAS Name: 1-[4-[(2-chlorophenyl)methyl]-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[4-[(2-chlorophenyl)methyl]-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl]urea Traditional Name: 1-benzyl-3-[4-(2-chlorobenzyl)-2-ethyl-3-keto-5H-1,4-benzoxazepin-7-yl]urea Formula: C26H26ClN3O3 MolecularWeight: 463.95594

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)NCC3=CC=CC=C3)CC4=CC=CC=C4Cl

Isomeric SMILES

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)NCC3=CC=CC=C3)CC4=CC=CC=C4Cl

InChI

InChI=1S/C26H26ClN3O3/c1-2-23-25(31)30(16-19-10-6-7-11-22(19)27)17-20-14-21(12-13-24(20)33-23)29-26(32)28-15-18-8-4-3-5-9-18/h3-14,23H,2,15-17H2,1H3,(H2,28,29,32)