N-(5-cyano-2-oxidanylidene-1-propan-2-yl-3H-1-benzazepin-3-yl)-3-(2,4-dichlorophenyl)propanamide

Systemtic Name: N-(5-cyano-2-oxidanylidene-1-propan-2-yl-3H-1-benzazepin-3-yl)-3-(2,4-dichlorophenyl)propanamide Openeye Name: N-(5-cyano-1-isopropyl-2-oxo-3H-1-benzazepin-3-yl)-3-(2,4-dichlorophenyl)propanamide CAS Name: N-(5-cyano-2-oxo-1-propan-2-yl-3H-1-benzazepin-3-yl)-3-(2,4-dichlorophenyl)propanamide IUPAC Name: N-(5-cyano-2-oxo-1-propan-2-yl-3H-1-benzazepin-3-yl)-3-(2,4-dichlorophenyl)propanamide Traditional Name: N-(5-cyano-1-isopropyl-2-keto-3H-1-benzazepin-3-yl)-3-(2,4-dichlorophenyl)propionamide Formula: C23H21Cl2N3O2 MolecularWeight: 442.33774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=CC=CC=C2C(=CC(C1=O)NC(=O)CCC3=C(C=C(C=C3)Cl)Cl)C#N

Isomeric SMILES

CC(C)N1C2=CC=CC=C2C(=CC(C1=O)NC(=O)CCC3=C(C=C(C=C3)Cl)Cl)C#N

InChI

InChI=1S/C23H21Cl2N3O2/c1-14(2)28-21-6-4-3-5-18(21)16(13-26)11-20(23(28)30)27-22(29)10-8-15-7-9-17(24)12-19(15)25/h3-7,9,11-12,14,20H,8,10H2,1-2H3,(H,27,29)