2-[(4,8-dimethylquinazolin-2-yl)amino]-6-(pyridin-2-ylsulfanylmethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-[(4,8-dimethylquinazolin-2-yl)amino]-6-(pyridin-2-ylsulfanylmethyl)-1H-pyrimidin-4-one Openeye Name: 2-[(4,8-dimethylquinazolin-2-yl)amino]-6-(2-pyridylsulfanylmethyl)-1H-pyrimidin-4-one CAS Name: 2-[(4,8-dimethyl-2-quinazolinyl)amino]-6-[(2-pyridinylthio)methyl]-1H-pyrimidin-4-one IUPAC Name: 2-[(4,8-dimethylquinazolin-2-yl)amino]-6-(pyridin-2-ylsulfanylmethyl)-1H-pyrimidin-4-one Traditional Name: 2-[(4,8-dimethylquinazolin-2-yl)amino]-6-[(2-pyridylthio)methyl]-1H-pyrimidin-4-one Formula: C20H18N6OS MolecularWeight: 390.46152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(N=C2C)NC3=NC(=O)C=C(N3)CSC4=CC=CC=N4

Isomeric SMILES

CC1=CC=CC2=C1N=C(N=C2C)NC3=NC(=O)C=C(N3)CSC4=CC=CC=N4

InChI

InChI=1S/C20H18N6OS/c1-12-6-5-7-15-13(2)22-19(25-18(12)15)26-20-23-14(10-16(27)24-20)11-28-17-8-3-4-9-21-17/h3-10H,11H2,1-2H3,(H2,22,23,24,25,26,27)