ethyl 3-[2-[(6-ethyl-4-methyl-quinazolin-2-yl)amino]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]propanoate

Systemtic Name: ethyl 3-[2-[(6-ethyl-4-methyl-quinazolin-2-yl)amino]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]propanoate Openeye Name: ethyl 3-[2-[(6-ethyl-4-methyl-quinazolin-2-yl)amino]-6-methyl-4-oxo-1H-pyrimidin-5-yl]propanoate CAS Name: 3-[2-[(6-ethyl-4-methyl-2-quinazolinyl)amino]-6-methyl-4-oxo-1H-pyrimidin-5-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[2-[(6-ethyl-4-methylquinazolin-2-yl)amino]-6-methyl-4-oxo-1H-pyrimidin-5-yl]propanoate Traditional Name: 3-[2-[(6-ethyl-4-methyl-quinazolin-2-yl)amino]-4-keto-6-methyl-1H-pyrimidin-5-yl]propionic acid ethyl ester Formula: C21H25N5O3 MolecularWeight: 395.4549

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(N=C2C)NC3=NC(=O)C(=C(N3)C)CCC(=O)OCC

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(N=C2C)NC3=NC(=O)C(=C(N3)C)CCC(=O)OCC

InChI

InChI=1S/C21H25N5O3/c1-5-14-7-9-17-16(11-14)13(4)23-20(24-17)26-21-22-12(3)15(19(28)25-21)8-10-18(27)29-6-2/h7,9,11H,5-6,8,10H2,1-4H3,(H2,22,23,24,25,26,28)