(5-methoxy-2-oxidanyl-phenyl)-[2-[(4-methylquinazolin-2-yl)amino]pyrimidin-5-yl]methanone

Systemtic Name: (5-methoxy-2-oxidanyl-phenyl)-[2-[(4-methylquinazolin-2-yl)amino]pyrimidin-5-yl]methanone Openeye Name: (2-hydroxy-5-methoxy-phenyl)-[2-[(4-methylquinazolin-2-yl)amino]pyrimidin-5-yl]methanone CAS Name: (2-hydroxy-5-methoxyphenyl)-[2-[(4-methyl-2-quinazolinyl)amino]-5-pyrimidinyl]methanone IUPAC Name: (2-hydroxy-5-methoxyphenyl)-[2-[(4-methylquinazolin-2-yl)amino]pyrimidin-5-yl]methanone Traditional Name: (2-hydroxy-5-methoxy-phenyl)-[2-[(4-methylquinazolin-2-yl)amino]pyrimidin-5-yl]methanone Formula: C21H17N5O3 MolecularWeight: 387.39138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=CC=CC=C12)NC3=NC=C(C=N3)C(=O)C4=C(C=CC(=C4)OC)O

Isomeric SMILES

CC1=NC(=NC2=CC=CC=C12)NC3=NC=C(C=N3)C(=O)C4=C(C=CC(=C4)OC)O

InChI

InChI=1S/C21H17N5O3/c1-12-15-5-3-4-6-17(15)25-21(24-12)26-20-22-10-13(11-23-20)19(28)16-9-14(29-2)7-8-18(16)27/h3-11,27H,1-2H3,(H,22,23,24,25,26)