ethyl 4-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 4-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-[4-(4-ethylbenzoyl)piperazin-1-yl]-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-[4-[(4-ethylphenyl)-oxomethyl]-1-piperazinyl]-2,5-dimethyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(4-ethylbenzoyl)piperazin-1-yl]-2,5-dimethylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-[4-(4-ethylbenzoyl)piperazino]-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C24H28N4O3S MolecularWeight: 452.56912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C4C(=C(SC4=NC(=N3)C)C(=O)OCC)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C4C(=C(SC4=NC(=N3)C)C(=O)OCC)C

InChI

InChI=1S/C24H28N4O3S/c1-5-17-7-9-18(10-8-17)23(29)28-13-11-27(12-14-28)21-19-15(3)20(24(30)31-6-2)32-22(19)26-16(4)25-21/h7-10H,5-6,11-14H2,1-4H3