2-[(4-methylquinazolin-2-yl)amino]-6-(pyrimidin-2-ylsulfanylmethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-[(4-methylquinazolin-2-yl)amino]-6-(pyrimidin-2-ylsulfanylmethyl)-1H-pyrimidin-4-one Openeye Name: 2-[(4-methylquinazolin-2-yl)amino]-6-(pyrimidin-2-ylsulfanylmethyl)-1H-pyrimidin-4-one CAS Name: 2-[(4-methyl-2-quinazolinyl)amino]-6-[(2-pyrimidinylthio)methyl]-1H-pyrimidin-4-one IUPAC Name: 2-[(4-methylquinazolin-2-yl)amino]-6-(pyrimidin-2-ylsulfanylmethyl)-1H-pyrimidin-4-one Traditional Name: 2-[(4-methylquinazolin-2-yl)amino]-6-[(2-pyrimidylthio)methyl]-1H-pyrimidin-4-one Formula: C18H15N7OS MolecularWeight: 377.423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=CC=CC=C12)NC3=NC(=O)C=C(N3)CSC4=NC=CC=N4

Isomeric SMILES

CC1=NC(=NC2=CC=CC=C12)NC3=NC(=O)C=C(N3)CSC4=NC=CC=N4

InChI

InChI=1S/C18H15N7OS/c1-11-13-5-2-3-6-14(13)23-16(21-11)25-17-22-12(9-15(26)24-17)10-27-18-19-7-4-8-20-18/h2-9H,10H2,1H3,(H2,21,22,23,24,25,26)