O4-ethyl O2-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-ethyl O2-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-ethyl ester O2-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl] ester IUPAC Name: 4-O-ethyl 2-O-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-ethyl ester O2-[(4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl] ester Formula: C17H17N3O5S MolecularWeight: 375.39898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC2=NC(=O)C3=C(N2)C=CS3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC2=NC(=O)C3=C(N2)C=CS3)C

InChI

InChI=1S/C17H17N3O5S/c1-4-24-16(22)12-8(2)13(18-9(12)3)17(23)25-7-11-19-10-5-6-26-14(10)15(21)20-11/h5-6,18H,4,7H2,1-3H3,(H,19,20,21)