ethyl 2,5-dimethyl-1-[2-oxidanylidene-2-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethoxy]ethyl]pyrrole-3-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-1-[2-oxidanylidene-2-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethoxy]ethyl]pyrrole-3-carboxylate Openeye Name: ethyl 2,5-dimethyl-1-[2-oxo-2-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethoxy]ethyl]pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-[2-oxo-2-[2-oxo-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethoxy]ethyl]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-1-[2-oxo-2-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethoxy]ethyl]pyrrole-3-carboxylate Traditional Name: 1-[2-keto-2-[2-keto-2-[4-(2-thenoyl)piperazino]ethoxy]ethyl]-2,5-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C22H27N3O6S MolecularWeight: 461.53128

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C)CC(=O)OCC(=O)N2CCN(CC2)C(=O)C3=CC=CS3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C)CC(=O)OCC(=O)N2CCN(CC2)C(=O)C3=CC=CS3)C

InChI

InChI=1S/C22H27N3O6S/c1-4-30-22(29)17-12-15(2)25(16(17)3)13-20(27)31-14-19(26)23-7-9-24(10-8-23)21(28)18-6-5-11-32-18/h5-6,11-12H,4,7-10,13-14H2,1-3H3