[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl] 3,5-dimethylbenzoate

Systemtic Name: [2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl] 3,5-dimethylbenzoate Openeye Name: [2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl] 3,5-dimethylbenzoate CAS Name: 3,5-dimethylbenzoic acid [2-oxo-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethyl] ester IUPAC Name: [2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl] 3,5-dimethylbenzoate Traditional Name: 3,5-dimethylbenzoic acid [2-keto-2-[4-(2-thenoyl)piperazino]ethyl] ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)OCC(=O)N2CCN(CC2)C(=O)C3=CC=CS3)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)OCC(=O)N2CCN(CC2)C(=O)C3=CC=CS3)C

InChI

InChI=1S/C20H22N2O4S/c1-14-10-15(2)12-16(11-14)20(25)26-13-18(23)21-5-7-22(8-6-21)19(24)17-4-3-9-27-17/h3-4,9-12H,5-8,13H2,1-2H3