6-(pyrimidin-2-ylsulfanylmethyl)-2-[(4,6,7-trimethylquinazolin-2-yl)amino]-1H-pyrimidin-4-one

Systemtic Name: 6-(pyrimidin-2-ylsulfanylmethyl)-2-[(4,6,7-trimethylquinazolin-2-yl)amino]-1H-pyrimidin-4-one Openeye Name: 6-(pyrimidin-2-ylsulfanylmethyl)-2-[(4,6,7-trimethylquinazolin-2-yl)amino]-1H-pyrimidin-4-one CAS Name: 6-[(2-pyrimidinylthio)methyl]-2-[(4,6,7-trimethyl-2-quinazolinyl)amino]-1H-pyrimidin-4-one IUPAC Name: 6-(pyrimidin-2-ylsulfanylmethyl)-2-[(4,6,7-trimethylquinazolin-2-yl)amino]-1H-pyrimidin-4-one Traditional Name: 6-[(2-pyrimidylthio)methyl]-2-[(4,6,7-trimethylquinazolin-2-yl)amino]-1H-pyrimidin-4-one Formula: C20H19N7OS MolecularWeight: 405.47616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=NC(=N2)NC3=NC(=O)C=C(N3)CSC4=NC=CC=N4)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=NC(=N2)NC3=NC(=O)C=C(N3)CSC4=NC=CC=N4)C)C

InChI

InChI=1S/C20H19N7OS/c1-11-7-15-13(3)23-18(25-16(15)8-12(11)2)27-19-24-14(9-17(28)26-19)10-29-20-21-5-4-6-22-20/h4-9H,10H2,1-3H3,(H2,23,24,25,26,27,28)