2-[(8-ethoxy-4-methyl-quinazolin-2-yl)amino]-6-(pyridin-2-ylsulfanylmethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-[(8-ethoxy-4-methyl-quinazolin-2-yl)amino]-6-(pyridin-2-ylsulfanylmethyl)-1H-pyrimidin-4-one Openeye Name: 2-[(8-ethoxy-4-methyl-quinazolin-2-yl)amino]-6-(2-pyridylsulfanylmethyl)-1H-pyrimidin-4-one CAS Name: 2-[(8-ethoxy-4-methyl-2-quinazolinyl)amino]-6-[(2-pyridinylthio)methyl]-1H-pyrimidin-4-one IUPAC Name: 2-[(8-ethoxy-4-methylquinazolin-2-yl)amino]-6-(pyridin-2-ylsulfanylmethyl)-1H-pyrimidin-4-one Traditional Name: 2-[(8-ethoxy-4-methyl-quinazolin-2-yl)amino]-6-[(2-pyridylthio)methyl]-1H-pyrimidin-4-one Formula: C21H20N6O2S MolecularWeight: 420.4875

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1N=C(N=C2C)NC3=NC(=O)C=C(N3)CSC4=CC=CC=N4

Isomeric SMILES

CCOC1=CC=CC2=C1N=C(N=C2C)NC3=NC(=O)C=C(N3)CSC4=CC=CC=N4

InChI

InChI=1S/C21H20N6O2S/c1-3-29-16-8-6-7-15-13(2)23-20(26-19(15)16)27-21-24-14(11-17(28)25-21)12-30-18-9-4-5-10-22-18/h4-11H,3,12H2,1-2H3,(H2,23,24,25,26,27,28)