2-[[5-chloranyl-2-[(6-methoxy-1-methyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-9-yl)amino]pyrimidin-4-yl]amino]-N-methyl-benzamide

Systemtic Name: 2-[[5-chloranyl-2-[(6-methoxy-1-methyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-9-yl)amino]pyrimidin-4-yl]amino]-N-methyl-benzamide Openeye Name: 2-[[5-chloro-2-[(6-methoxy-1-methyl-2-oxo-4,5-dihydro-3H-1-benzazepin-9-yl)amino]pyrimidin-4-yl]amino]-N-methyl-benzamide CAS Name: 2-[[5-chloro-2-[(6-methoxy-1-methyl-2-oxo-4,5-dihydro-3H-1-benzazepin-9-yl)amino]-4-pyrimidinyl]amino]-N-methylbenzamide IUPAC Name: 2-[[5-chloro-2-[(6-methoxy-1-methyl-2-oxo-4,5-dihydro-3H-1-benzazepin-9-yl)amino]pyrimidin-4-yl]amino]-N-methylbenzamide Traditional Name: 2-[[5-chloro-2-[(2-keto-6-methoxy-1-methyl-4,5-dihydro-3H-1-benzazepin-9-yl)amino]pyrimidin-4-yl]amino]-N-methyl-benzamide Formula: C24H25ClN6O3 MolecularWeight: 480.9467

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=CC=C1NC2=NC(=NC=C2Cl)NC3=C4C(=C(C=C3)OC)CCCC(=O)N4C

Isomeric SMILES

CNC(=O)C1=CC=CC=C1NC2=NC(=NC=C2Cl)NC3=C4C(=C(C=C3)OC)CCCC(=O)N4C

InChI

InChI=1S/C24H25ClN6O3/c1-26-23(33)14-7-4-5-9-17(14)28-22-16(25)13-27-24(30-22)29-18-11-12-19(34-3)15-8-6-10-20(32)31(2)21(15)18/h4-5,7,9,11-13H,6,8,10H2,1-3H3,(H,26,33)(H2,27,28,29,30)