3-[[2-azanyl-6-[(3-methoxyphenyl)amino]pyrimidin-4-yl]amino]-N-[(4-dimethylaminophenyl)methyl]benzamide

Systemtic Name: 3-[[2-azanyl-6-[(3-methoxyphenyl)amino]pyrimidin-4-yl]amino]-N-[(4-dimethylaminophenyl)methyl]benzamide Openeye Name: 3-[[2-amino-6-(3-methoxyanilino)pyrimidin-4-yl]amino]-N-[(4-dimethylaminophenyl)methyl]benzamide CAS Name: 3-[[2-amino-6-(3-methoxyanilino)-4-pyrimidinyl]amino]-N-[(4-dimethylaminophenyl)methyl]benzamide IUPAC Name: 3-[[2-amino-6-(3-methoxyanilino)pyrimidin-4-yl]amino]-N-[(4-dimethylaminophenyl)methyl]benzamide Traditional Name: 3-[[2-amino-6-(m-anisidino)pyrimidin-4-yl]amino]-N-[4-(dimethylamino)benzyl]benzamide Formula: C27H29N7O2 MolecularWeight: 483.56486

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CNC(=O)C2=CC(=CC=C2)NC3=CC(=NC(=N3)N)NC4=CC(=CC=C4)OC

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CNC(=O)C2=CC(=CC=C2)NC3=CC(=NC(=N3)N)NC4=CC(=CC=C4)OC

InChI

InChI=1S/C27H29N7O2/c1-34(2)22-12-10-18(11-13-22)17-29-26(35)19-6-4-7-20(14-19)30-24-16-25(33-27(28)32-24)31-21-8-5-9-23(15-21)36-3/h4-16H,17H2,1-3H3,(H,29,35)(H4,28,30,31,32,33)