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

Systemtic Name: 3-[(1,3-dimethylpyrazol-4-yl)methyl]-6-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(1,3-dimethylpyrazol-4-yl)methyl]-6-phenyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[(1,3-dimethyl-4-pyrazolyl)methyl]-6-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 3-[(1,3-dimethylpyrazol-4-yl)methyl]-6-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[(1,3-dimethylpyrazol-4-yl)methyl]-6-phenyl-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=NN(C=C1CN2C(=O)C3=C(NC2=S)SC(=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=NN(C=C1CN2C(=O)C3=C(NC2=S)SC(=C3)C4=CC=CC=C4)C

InChI

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