2-[[5-chloranyl-2-[(7-methoxy-1-methyl-2-oxidanylidene-4,5-dihydro-3,1-benzoxazepin-6-yl)amino]pyrimidin-4-yl]amino]-N-methyl-benzamide

Systemtic Name: 2-[[5-chloranyl-2-[(7-methoxy-1-methyl-2-oxidanylidene-4,5-dihydro-3,1-benzoxazepin-6-yl)amino]pyrimidin-4-yl]amino]-N-methyl-benzamide Openeye Name: 2-[[5-chloro-2-[(7-methoxy-1-methyl-2-oxo-4,5-dihydro-3,1-benzoxazepin-6-yl)amino]pyrimidin-4-yl]amino]-N-methyl-benzamide CAS Name: 2-[[5-chloro-2-[(7-methoxy-1-methyl-2-oxo-4,5-dihydro-3,1-benzoxazepin-6-yl)amino]-4-pyrimidinyl]amino]-N-methylbenzamide IUPAC Name: 2-[[5-chloro-2-[(7-methoxy-1-methyl-2-oxo-4,5-dihydro-3,1-benzoxazepin-6-yl)amino]pyrimidin-4-yl]amino]-N-methylbenzamide Traditional Name: 2-[[5-chloro-2-[(2-keto-7-methoxy-1-methyl-4,5-dihydro-3,1-benzoxazepin-6-yl)amino]pyrimidin-4-yl]amino]-N-methyl-benzamide Formula: C23H23ClN6O4 MolecularWeight: 482.91952

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=CC=C1NC2=NC(=NC=C2Cl)NC3=C(C=CC4=C3CCOC(=O)N4C)OC

Isomeric SMILES

CNC(=O)C1=CC=CC=C1NC2=NC(=NC=C2Cl)NC3=C(C=CC4=C3CCOC(=O)N4C)OC

InChI

InChI=1S/C23H23ClN6O4/c1-25-21(31)13-6-4-5-7-16(13)27-20-15(24)12-26-22(29-20)28-19-14-10-11-34-23(32)30(2)17(14)8-9-18(19)33-3/h4-9,12H,10-11H2,1-3H3,(H,25,31)(H2,26,27,28,29)