(1-phenylpyrazol-4-yl)methyl 3,5-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: (1-phenylpyrazol-4-yl)methyl 3,5-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: (1-phenylpyrazol-4-yl)methyl 3,5-dimethyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 3,5-dimethyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid (1-phenyl-4-pyrazolyl)methyl ester IUPAC Name: (1-phenylpyrazol-4-yl)methyl 3,5-dimethyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-3,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid (1-phenylpyrazol-4-yl)methyl ester Formula: C19H16N4O3S MolecularWeight: 380.42034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)C)C(=O)OCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)C)C(=O)OCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C19H16N4O3S/c1-12-15-17(20-11-22(2)18(15)24)27-16(12)19(25)26-10-13-8-21-23(9-13)14-6-4-3-5-7-14/h3-9,11H,10H2,1-2H3