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

Systemtic Name: 6-ethyl-3-[(1-ethylpyrazol-4-yl)methyl]-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-ethyl-3-[(1-ethylpyrazol-4-yl)methyl]-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-ethyl-3-[(1-ethyl-4-pyrazolyl)methyl]-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 6-ethyl-3-[(1-ethylpyrazol-4-yl)methyl]-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-ethyl-3-[(1-ethylpyrazol-4-yl)methyl]-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one Formula: C14H16N4OS2 MolecularWeight: 320.43304

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N4OS2/c1-3-10-5-11-12(21-10)16-14(20)18(13(11)19)8-9-6-15-17(4-2)7-9/h5-7H,3-4,8H2,1-2H3,(H,16,20)