ethyl 3-(3,4-dimethoxyphenyl)-7-(4-methylphenyl)carbonyl-pyrrolo[1,2-c]pyrimidine-5-carboxylate

Systemtic Name: ethyl 3-(3,4-dimethoxyphenyl)-7-(4-methylphenyl)carbonyl-pyrrolo[1,2-c]pyrimidine-5-carboxylate Openeye Name: ethyl 3-(3,4-dimethoxyphenyl)-7-(4-methylbenzoyl)pyrrolo[1,2-c]pyrimidine-5-carboxylate CAS Name: 3-(3,4-dimethoxyphenyl)-7-[(4-methylphenyl)-oxomethyl]-5-pyrrolo[1,2-c]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(3,4-dimethoxyphenyl)-7-(4-methylbenzoyl)pyrrolo[1,2-c]pyrimidine-5-carboxylate Traditional Name: 3-(3,4-dimethoxyphenyl)-7-p-toluoyl-pyrrolo[1,2-c]pyrimidine-5-carboxylic acid ethyl ester Formula: C26H24N2O5 MolecularWeight: 444.47916

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C=C(N=CN2C(=C1)C(=O)C3=CC=C(C=C3)C)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CCOC(=O)C1=C2C=C(N=CN2C(=C1)C(=O)C3=CC=C(C=C3)C)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C26H24N2O5/c1-5-33-26(30)19-13-22(25(29)17-8-6-16(2)7-9-17)28-15-27-20(14-21(19)28)18-10-11-23(31-3)24(12-18)32-4/h6-15H,5H2,1-4H3