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

Systemtic Name: 3-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-6-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-6-phenyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[(1-ethyl-5-methyl-4-pyrazolyl)methyl]-6-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 3-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-6-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-6-phenyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one Formula: C19H18N4OS2 MolecularWeight: 382.50242

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)CN2C(=O)C3=C(NC2=S)SC(=C3)C4=CC=CC=C4)C

Isomeric SMILES

CCN1C(=C(C=N1)CN2C(=O)C3=C(NC2=S)SC(=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C19H18N4OS2/c1-3-23-12(2)14(10-20-23)11-22-18(24)15-9-16(13-7-5-4-6-8-13)26-17(15)21-19(22)25/h4-10H,3,11H2,1-2H3,(H,21,25)