1-(3-methyl-6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)-3-(2-methylphenyl)urea

Systemtic Name: 1-(3-methyl-6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)-3-(2-methylphenyl)urea Openeye Name: 1-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)-3-(o-tolyl)urea CAS Name: 1-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)-3-(2-methylphenyl)urea IUPAC Name: 1-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)-3-(2-methylphenyl)urea Traditional Name: 1-(6-keto-3-methyl-5H-benzo[b][1,4]benzoxazepin-8-yl)-3-(o-tolyl)urea Formula: C22H19N3O3 MolecularWeight: 373.40456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NC(=O)NC4=CC=CC=C4C)C(=O)N2

Isomeric SMILES

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NC(=O)NC4=CC=CC=C4C)C(=O)N2

InChI

InChI=1S/C22H19N3O3/c1-13-7-9-20-18(11-13)24-21(26)16-12-15(8-10-19(16)28-20)23-22(27)25-17-6-4-3-5-14(17)2/h3-12H,1-2H3,(H,24,26)(H2,23,25,27)