(E)-3-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-4-oxidanylidene-pent-2-en-2-olate

Systemtic Name: (E)-3-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-4-oxidanylidene-pent-2-en-2-olate Openeye Name: (E)-3-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-4-oxo-pent-2-en-2-olate CAS Name: (E)-3-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]-4-oxo-2-penten-2-olate IUPAC Name: (E)-3-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-4-oxopent-2-en-2-olate Traditional Name: (E)-3-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]-4-keto-pent-2-en-2-olate Formula: C13H13N2O2S2- MolecularWeight: 293.38452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC=N2)SC(=C(C)[O-])C(=O)C)C

Isomeric SMILES

CC1=C(SC2=C1C(=NC=N2)S/C(=C(\C)/[O-])/C(=O)C)C

InChI

InChI=1S/C13H14N2O2S2/c1-6-9(4)18-12-10(6)13(15-5-14-12)19-11(7(2)16)8(3)17/h5,16H,1-4H3/p-1/b11-7+