methyl 5-methyl-4-oxidanylidene-3-pyrrol-1-yl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: methyl 5-methyl-4-oxidanylidene-3-pyrrol-1-yl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 5-methyl-4-oxo-3-pyrrol-1-yl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-(1-pyrrolyl)-6-thieno[2,3-d]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-4-oxo-3-pyrrol-1-ylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-3-pyrrol-1-yl-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C13H11N3O3S MolecularWeight: 289.30974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)N3C=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)N3C=CC=C3)C(=O)OC

InChI

InChI=1S/C13H11N3O3S/c1-8-9-11(20-10(8)13(18)19-2)14-7-16(12(9)17)15-5-3-4-6-15/h3-7H,1-2H3