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

Systemtic Name: ethyl 7-(4-bromophenyl)carbonyl-3-(2,4-dimethylphenyl)pyrrolo[1,2-c]pyrimidine-5-carboxylate Openeye Name: ethyl 7-(4-bromobenzoyl)-3-(2,4-dimethylphenyl)pyrrolo[1,2-c]pyrimidine-5-carboxylate CAS Name: 7-[(4-bromophenyl)-oxomethyl]-3-(2,4-dimethylphenyl)-5-pyrrolo[1,2-c]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-(4-bromobenzoyl)-3-(2,4-dimethylphenyl)pyrrolo[1,2-c]pyrimidine-5-carboxylate Traditional Name: 7-(4-bromobenzoyl)-3-(2,4-dimethylphenyl)pyrrolo[1,2-c]pyrimidine-5-carboxylic acid ethyl ester Formula: C25H21BrN2O3 MolecularWeight: 477.34984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H21BrN2O3/c1-4-31-25(30)20-12-23(24(29)17-6-8-18(26)9-7-17)28-14-27-21(13-22(20)28)19-10-5-15(2)11-16(19)3/h5-14H,4H2,1-3H3