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

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

CCC1=CC2=C(S1)NC(=S)N(C2=O)CC3=CC=NN3

Isomeric SMILES

CCC1=CC2=C(S1)NC(=S)N(C2=O)CC3=CC=NN3

InChI

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