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

Systemtic Name: methyl 2-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 2-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxo-ethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[2-(2,5-dimethyl-1-propyl-3-pyrrolyl)-2-oxoethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[2-(2,5-dimethyl-1-propylpyrrol-3-yl)-2-oxoethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-keto-ethyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C(=O)CC2=NC3=C(C(=C(S3)C(=O)OC)C)C(=O)N2)C

Isomeric SMILES

CCCN1C(=CC(=C1C)C(=O)CC2=NC3=C(C(=C(S3)C(=O)OC)C)C(=O)N2)C

InChI

InChI=1S/C20H23N3O4S/c1-6-7-23-10(2)8-13(12(23)4)14(24)9-15-21-18(25)16-11(3)17(20(26)27-5)28-19(16)22-15/h8H,6-7,9H2,1-5H3,(H,21,22,25)