3-[(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]pentane-2,4-dione

Systemtic Name: 3-[(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]pentane-2,4-dione Openeye Name: 3-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]pentane-2,4-dione CAS Name: 3-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)thio]pentane-2,4-dione IUPAC Name: 3-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]pentane-2,4-dione Traditional Name: 3-[(4-keto-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-2-yl)thio]pentane-2,4-dione Formula: C13H14N2O3S2 MolecularWeight: 310.39186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O3S2/c1-5-8(4)19-12-9(5)11(18)14-13(15-12)20-10(6(2)16)7(3)17/h10H,1-4H3,(H,14,15,18)