dimethyl 5-(4-cyclopropylcarbonylpiperazin-1-yl)sulfonyl-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-(4-cyclopropylcarbonylpiperazin-1-yl)sulfonyl-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-[4-(cyclopropanecarbonyl)piperazin-1-yl]sulfonyl-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]sulfonyl]-3-methylthiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[4-(cyclopropanecarbonyl)piperazin-1-yl]sulfonyl-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[4-(cyclopropanecarbonyl)piperazino]sulfonyl-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C17H22N2O7S2 MolecularWeight: 430.49578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)S(=O)(=O)N2CCN(CC2)C(=O)C3CC3)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)S(=O)(=O)N2CCN(CC2)C(=O)C3CC3)C(=O)OC

InChI

InChI=1S/C17H22N2O7S2/c1-10-12(15(21)25-2)17(27-13(10)16(22)26-3)28(23,24)19-8-6-18(7-9-19)14(20)11-4-5-11/h11H,4-9H2,1-3H3