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

Systemtic Name: 2-[(4,8-dimethylquinazolin-2-yl)amino]-6-(pyrimidin-2-ylsulfanylmethyl)-1H-pyrimidin-4-one Openeye Name: 2-[(4,8-dimethylquinazolin-2-yl)amino]-6-(pyrimidin-2-ylsulfanylmethyl)-1H-pyrimidin-4-one CAS Name: 2-[(4,8-dimethyl-2-quinazolinyl)amino]-6-[(2-pyrimidinylthio)methyl]-1H-pyrimidin-4-one IUPAC Name: 2-[(4,8-dimethylquinazolin-2-yl)amino]-6-(pyrimidin-2-ylsulfanylmethyl)-1H-pyrimidin-4-one Traditional Name: 2-[(4,8-dimethylquinazolin-2-yl)amino]-6-[(2-pyrimidylthio)methyl]-1H-pyrimidin-4-one Formula: C19H17N7OS MolecularWeight: 391.44958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17N7OS/c1-11-5-3-6-14-12(2)22-17(25-16(11)14)26-18-23-13(9-15(27)24-18)10-28-19-20-7-4-8-21-19/h3-9H,10H2,1-2H3,(H2,22,23,24,25,26,27)