5,6-dimethyl-3-(1H-pyrazol-5-ylmethyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-3-(1H-pyrazol-5-ylmethyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-3-(1H-pyrazol-5-ylmethyl)-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-3-(1H-pyrazol-5-ylmethyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5,6-dimethyl-3-(1H-pyrazol-5-ylmethyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-3-(1H-pyrazol-5-ylmethyl)-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one Formula: C12H12N4OS2 MolecularWeight: 292.37988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=S)N2)CC3=CC=NN3)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=S)N2)CC3=CC=NN3)C

InChI

InChI=1S/C12H12N4OS2/c1-6-7(2)19-10-9(6)11(17)16(12(18)14-10)5-8-3-4-13-15-8/h3-4H,5H2,1-2H3,(H,13,15)(H,14,18)