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

Systemtic Name: diethyl 7-(4-chlorophenyl)carbonyl-3-thiophen-2-yl-pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate Openeye Name: diethyl 7-(4-chlorobenzoyl)-3-(2-thienyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate CAS Name: 7-[(4-chlorophenyl)-oxomethyl]-3-thiophen-2-ylpyrrolo[1,2-c]pyrimidine-5,6-dicarboxylic acid diethyl ester IUPAC Name: diethyl 7-(4-chlorobenzoyl)-3-thiophen-2-ylpyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate Traditional Name: 7-(4-chlorobenzoyl)-3-(2-thienyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylic acid diethyl ester Formula: C24H19ClN2O5S MolecularWeight: 482.93606

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C=C(N=CN2C(=C1C(=O)OCC)C(=O)C3=CC=C(C=C3)Cl)C4=CC=CS4

Isomeric SMILES

CCOC(=O)C1=C2C=C(N=CN2C(=C1C(=O)OCC)C(=O)C3=CC=C(C=C3)Cl)C4=CC=CS4

InChI

InChI=1S/C24H19ClN2O5S/c1-3-31-23(29)19-17-12-16(18-6-5-11-33-18)26-13-27(17)21(20(19)24(30)32-4-2)22(28)14-7-9-15(25)10-8-14/h5-13H,3-4H2,1-2H3