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

Systemtic Name: 5,6-dimethyl-2-(pyrimidin-2-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-(pyrimidin-2-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[(2-pyrimidinylthio)methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5,6-dimethyl-2-(pyrimidin-2-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-2-[(2-pyrimidylthio)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C13H12N4OS2 MolecularWeight: 304.39058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CSC3=NC=CC=N3)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CSC3=NC=CC=N3)C

InChI

InChI=1S/C13H12N4OS2/c1-7-8(2)20-12-10(7)11(18)16-9(17-12)6-19-13-14-4-3-5-15-13/h3-5H,6H2,1-2H3,(H,16,17,18)