6-ethyl-3-[(1-methylpyrazol-4-yl)methyl]-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 6-ethyl-3-[(1-methylpyrazol-4-yl)methyl]-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-ethyl-3-[(1-methylpyrazol-4-yl)methyl]-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-ethyl-3-[(1-methyl-4-pyrazolyl)methyl]-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 6-ethyl-3-[(1-methylpyrazol-4-yl)methyl]-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-ethyl-3-[(1-methylpyrazol-4-yl)methyl]-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one Formula: C13H14N4OS2 MolecularWeight: 306.40646

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)NC(=S)N(C2=O)CC3=CN(N=C3)C

Isomeric SMILES

CCC1=CC2=C(S1)NC(=S)N(C2=O)CC3=CN(N=C3)C

InChI

InChI=1S/C13H14N4OS2/c1-3-9-4-10-11(20-9)15-13(19)17(12(10)18)7-8-5-14-16(2)6-8/h4-6H,3,7H2,1-2H3,(H,15,19)