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

Systemtic Name: ethyl 3-(2,5-dimethylpyrrol-1-yl)-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 3-(2,5-dimethylpyrrol-1-yl)-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 3-(2,5-dimethyl-1-pyrrolyl)-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(2,5-dimethylpyrrol-1-yl)-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-(2,5-dimethylpyrrol-1-yl)-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C16H17N3O3S MolecularWeight: 331.38948

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)N3C(=CC=C3C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)N3C(=CC=C3C)C)C

InChI

InChI=1S/C16H17N3O3S/c1-5-22-16(21)13-11(4)12-14(23-13)17-8-18(15(12)20)19-9(2)6-7-10(19)3/h6-8H,5H2,1-4H3