ethyl 3-[(5-ethoxycarbonyl-2,4-dimethyl-pyrrol-3-ylidene)methylamino]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 3-[(5-ethoxycarbonyl-2,4-dimethyl-pyrrol-3-ylidene)methylamino]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 3-[(5-ethoxycarbonyl-2,4-dimethyl-pyrrol-3-ylidene)methylamino]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 3-[(5-ethoxycarbonyl-2,4-dimethyl-3-pyrrolylidene)methylamino]-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(5-ethoxycarbonyl-2,4-dimethylpyrrol-3-ylidene)methylamino]-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-[(5-carbethoxy-2,4-dimethyl-pyrrol-3-ylidene)methylamino]-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C20H22N4O5S MolecularWeight: 430.47748

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CNN2C=NC3=C(C2=O)C(=C(S3)C(=O)OCC)C)C(=N1)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=CNN2C=NC3=C(C2=O)C(=C(S3)C(=O)OCC)C)C(=N1)C)C

InChI

InChI=1S/C20H22N4O5S/c1-6-28-19(26)15-10(3)13(12(5)23-15)8-22-24-9-21-17-14(18(24)25)11(4)16(30-17)20(27)29-7-2/h8-9,22H,6-7H2,1-5H3