N-(4-bromanyl-3-methyl-phenyl)-4-(8-methyl-5-oxidanylidene-pyrido[2,3-b][1,5]benzoxazepin-6-yl)butanamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-4-(8-methyl-5-oxidanylidene-pyrido[2,3-b][1,5]benzoxazepin-6-yl)butanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-4-(8-methyl-5-oxo-pyrido[2,3-b][1,5]benzoxazepin-6-yl)butanamide CAS Name: N-(4-bromo-3-methylphenyl)-4-(8-methyl-5-oxo-6-pyrido[2,3-b][1,5]benzoxazepinyl)butanamide IUPAC Name: N-(4-bromo-3-methylphenyl)-4-(8-methyl-5-oxopyrido[2,3-b][1,5]benzoxazepin-6-yl)butanamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-4-(5-keto-8-methyl-pyrido[2,3-b][1,5]benzoxazepin-6-yl)butyramide Formula: C24H22BrN3O3 MolecularWeight: 480.35378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC3=C(C=CC=N3)C(=O)N2CCCC(=O)NC4=CC(=C(C=C4)Br)C

Isomeric SMILES

CC1=CC2=C(C=C1)OC3=C(C=CC=N3)C(=O)N2CCCC(=O)NC4=CC(=C(C=C4)Br)C

InChI

InChI=1S/C24H22BrN3O3/c1-15-7-10-21-20(13-15)28(24(30)18-5-3-11-26-23(18)31-21)12-4-6-22(29)27-17-8-9-19(25)16(2)14-17/h3,5,7-11,13-14H,4,6,12H2,1-2H3,(H,27,29)