methyl 5-[4-(2-chlorophenyl)carbonylpiperazin-1-yl]sulfonylthiophene-3-carboxylate

Systemtic Name: methyl 5-[4-(2-chlorophenyl)carbonylpiperazin-1-yl]sulfonylthiophene-3-carboxylate Openeye Name: methyl 5-[4-(2-chlorobenzoyl)piperazin-1-yl]sulfonylthiophene-3-carboxylate CAS Name: 5-[[4-[(2-chlorophenyl)-oxomethyl]-1-piperazinyl]sulfonyl]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[4-(2-chlorobenzoyl)piperazin-1-yl]sulfonylthiophene-3-carboxylate Traditional Name: 5-[4-(2-chlorobenzoyl)piperazino]sulfonylthiophene-3-carboxylic acid methyl ester Formula: C17H17ClN2O5S2 MolecularWeight: 428.91028

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CSC(=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3Cl

Isomeric SMILES

COC(=O)C1=CSC(=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C17H17ClN2O5S2/c1-25-17(22)12-10-15(26-11-12)27(23,24)20-8-6-19(7-9-20)16(21)13-4-2-3-5-14(13)18/h2-5,10-11H,6-9H2,1H3