2-[(7-ethyl-4-methyl-quinazolin-2-yl)amino]-6-methyl-5-(3-methylbutyl)-1H-pyrimidin-4-one

Systemtic Name: 2-[(7-ethyl-4-methyl-quinazolin-2-yl)amino]-6-methyl-5-(3-methylbutyl)-1H-pyrimidin-4-one Openeye Name: 2-[(7-ethyl-4-methyl-quinazolin-2-yl)amino]-5-isopentyl-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[(7-ethyl-4-methyl-2-quinazolinyl)amino]-6-methyl-5-(3-methylbutyl)-1H-pyrimidin-4-one IUPAC Name: 2-[(7-ethyl-4-methylquinazolin-2-yl)amino]-6-methyl-5-(3-methylbutyl)-1H-pyrimidin-4-one Traditional Name: 2-[(7-ethyl-4-methyl-quinazolin-2-yl)amino]-5-isoamyl-6-methyl-1H-pyrimidin-4-one Formula: C21H27N5O MolecularWeight: 365.47198

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=NC(=N2)NC3=NC(=O)C(=C(N3)C)CCC(C)C)C

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=NC(=N2)NC3=NC(=O)C(=C(N3)C)CCC(C)C)C

InChI

InChI=1S/C21H27N5O/c1-6-15-8-10-16-13(4)22-20(24-18(16)11-15)26-21-23-14(5)17(19(27)25-21)9-7-12(2)3/h8,10-12H,6-7,9H2,1-5H3,(H2,22,23,24,25,26,27)