3-[[3-[[2-azanyl-6-[(3-methoxyphenyl)amino]pyrimidin-4-yl]amino]phenyl]carbonylamino]benzamide

Systemtic Name: 3-[[3-[[2-azanyl-6-[(3-methoxyphenyl)amino]pyrimidin-4-yl]amino]phenyl]carbonylamino]benzamide Openeye Name: 3-[[3-[[2-amino-6-(3-methoxyanilino)pyrimidin-4-yl]amino]benzoyl]amino]benzamide CAS Name: 3-[[[3-[[2-amino-6-(3-methoxyanilino)-4-pyrimidinyl]amino]phenyl]-oxomethyl]amino]benzamide IUPAC Name: 3-[[3-[[2-amino-6-(3-methoxyanilino)pyrimidin-4-yl]amino]benzoyl]amino]benzamide Traditional Name: 3-[[3-[[2-amino-6-(m-anisidino)pyrimidin-4-yl]amino]benzoyl]amino]benzamide Formula: C25H23N7O3 MolecularWeight: 469.49522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=NC(=NC(=C2)NC3=CC=CC(=C3)C(=O)NC4=CC=CC(=C4)C(=O)N)N

Isomeric SMILES

COC1=CC=CC(=C1)NC2=NC(=NC(=C2)NC3=CC=CC(=C3)C(=O)NC4=CC=CC(=C4)C(=O)N)N

InChI

InChI=1S/C25H23N7O3/c1-35-20-10-4-9-19(13-20)29-22-14-21(31-25(27)32-22)28-17-7-3-6-16(12-17)24(34)30-18-8-2-5-15(11-18)23(26)33/h2-14H,1H3,(H2,26,33)(H,30,34)(H4,27,28,29,31,32)