[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl] 4-ethyl-5-methyl-thiophene-2-carboxylate

Systemtic Name: [2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl] 4-ethyl-5-methyl-thiophene-2-carboxylate Openeye Name: [2-(4-methylsulfonylpiperazin-1-yl)-2-oxo-ethyl] 4-ethyl-5-methyl-thiophene-2-carboxylate CAS Name: 4-ethyl-5-methyl-2-thiophenecarboxylic acid [2-(4-methylsulfonyl-1-piperazinyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfonylpiperazin-1-yl)-2-oxoethyl] 4-ethyl-5-methylthiophene-2-carboxylate Traditional Name: 4-ethyl-5-methyl-thiophene-2-carboxylic acid [2-keto-2-(4-mesylpiperazino)ethyl] ester Formula: C15H22N2O5S2 MolecularWeight: 374.47558

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1)C(=O)OCC(=O)N2CCN(CC2)S(=O)(=O)C)C

Isomeric SMILES

CCC1=C(SC(=C1)C(=O)OCC(=O)N2CCN(CC2)S(=O)(=O)C)C

InChI

InChI=1S/C15H22N2O5S2/c1-4-12-9-13(23-11(12)2)15(19)22-10-14(18)16-5-7-17(8-6-16)24(3,20)21/h9H,4-8,10H2,1-3H3