dimethyl 7-(3,4-dimethoxyphenyl)carbonyl-3-thiophen-2-yl-pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate

Systemtic Name: dimethyl 7-(3,4-dimethoxyphenyl)carbonyl-3-thiophen-2-yl-pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate Openeye Name: dimethyl 7-(3,4-dimethoxybenzoyl)-3-(2-thienyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate CAS Name: 7-[(3,4-dimethoxyphenyl)-oxomethyl]-3-thiophen-2-ylpyrrolo[1,2-c]pyrimidine-5,6-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 7-(3,4-dimethoxybenzoyl)-3-thiophen-2-ylpyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate Traditional Name: 3-(2-thienyl)-7-veratroyl-pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylic acid dimethyl ester Formula: C24H20N2O7S MolecularWeight: 480.4898

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C2=C(C(=C3N2C=NC(=C3)C4=CC=CS4)C(=O)OC)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)C2=C(C(=C3N2C=NC(=C3)C4=CC=CS4)C(=O)OC)C(=O)OC)OC

InChI

InChI=1S/C24H20N2O7S/c1-30-16-8-7-13(10-17(16)31-2)22(27)21-20(24(29)33-4)19(23(28)32-3)15-11-14(25-12-26(15)21)18-6-5-9-34-18/h5-12H,1-4H3