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

Systemtic Name: 5,6-dimethyl-2-(2-oxidanylidenepropylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(acetonylsulfanylmethyl)-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[(2-oxopropylthio)methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5,6-dimethyl-2-(2-oxopropylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(acetonylthio)methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C12H14N2O2S2 MolecularWeight: 282.38176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CSCC(=O)C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CSCC(=O)C)C

InChI

InChI=1S/C12H14N2O2S2/c1-6(15)4-17-5-9-13-11(16)10-7(2)8(3)18-12(10)14-9/h4-5H2,1-3H3,(H,13,14,16)