ethyl 4-azanyl-2-[(4,6-dimethylquinazolin-2-yl)amino]-6-phenyl-pyrimidine-5-carboxylate hydrochloride

Systemtic Name: ethyl 4-azanyl-2-[(4,6-dimethylquinazolin-2-yl)amino]-6-phenyl-pyrimidine-5-carboxylate hydrochloride Openeye Name: ethyl 4-amino-2-[(4,6-dimethylquinazolin-2-yl)amino]-6-phenyl-pyrimidine-5-carboxylate hydrochloride CAS Name: 4-amino-2-[(4,6-dimethyl-2-quinazolinyl)amino]-6-phenyl-5-pyrimidinecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 4-amino-2-[(4,6-dimethylquinazolin-2-yl)amino]-6-phenylpyrimidine-5-carboxylate hydrochloride Traditional Name: 4-amino-2-[(4,6-dimethylquinazolin-2-yl)amino]-6-phenyl-pyrimidine-5-carboxylic acid ethyl ester hydrochloride Formula: C23H23ClN6O2 MolecularWeight: 450.92072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N=C1N)NC2=NC3=C(C=C(C=C3)C)C(=N2)C)C4=CC=CC=C4.Cl

Isomeric SMILES

CCOC(=O)C1=C(N=C(N=C1N)NC2=NC3=C(C=C(C=C3)C)C(=N2)C)C4=CC=CC=C4.Cl

InChI

InChI=1S/C23H22N6O2.ClH/c1-4-31-21(30)18-19(15-8-6-5-7-9-15)27-23(28-20(18)24)29-22-25-14(3)16-12-13(2)10-11-17(16)26-22;/h5-12H,4H2,1-3H3,(H3,24,25,26,27,28,29);1H