3-(1,5-dimethylpyrazol-3-yl)-6-(phenylmethyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(1,5-dimethylpyrazol-3-yl)-6-(phenylmethyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-benzyl-3-(1,5-dimethylpyrazol-3-yl)-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(1,5-dimethyl-3-pyrazolyl)-6-(phenylmethyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 6-benzyl-3-(1,5-dimethylpyrazol-3-yl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-benzyl-3-(1,5-dimethylpyrazol-3-yl)-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one Formula: C18H16N4OS2 MolecularWeight: 368.47584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C)N2C(=O)C3=C(NC2=S)SC(=C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NN1C)N2C(=O)C3=C(NC2=S)SC(=C3)CC4=CC=CC=C4

InChI

InChI=1S/C18H16N4OS2/c1-11-8-15(20-21(11)2)22-17(23)14-10-13(25-16(14)19-18(22)24)9-12-6-4-3-5-7-12/h3-8,10H,9H2,1-2H3,(H,19,24)