6-methyl-5-(4-methylphenyl)-2-(pyrimidin-2-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 6-methyl-5-(4-methylphenyl)-2-(pyrimidin-2-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-methyl-5-(p-tolyl)-2-(pyrimidin-2-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-methyl-5-(4-methylphenyl)-2-[(2-pyrimidinylthio)methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 6-methyl-5-(4-methylphenyl)-2-(pyrimidin-2-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-methyl-5-(p-tolyl)-2-[(2-pyrimidylthio)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C19H16N4OS2 MolecularWeight: 380.48654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC3=C2C(=O)NC(=N3)CSC4=NC=CC=N4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC3=C2C(=O)NC(=N3)CSC4=NC=CC=N4)C

InChI

InChI=1S/C19H16N4OS2/c1-11-4-6-13(7-5-11)15-12(2)26-18-16(15)17(24)22-14(23-18)10-25-19-20-8-3-9-21-19/h3-9H,10H2,1-2H3,(H,22,23,24)