methyl 5-[4-[2,2-bis(chloranyl)-1-methyl-cyclopropyl]carbonylpiperazin-1-yl]sulfonylthiophene-3-carboxylate

Systemtic Name: methyl 5-[4-[2,2-bis(chloranyl)-1-methyl-cyclopropyl]carbonylpiperazin-1-yl]sulfonylthiophene-3-carboxylate Openeye Name: methyl 5-[4-(2,2-dichloro-1-methyl-cyclopropanecarbonyl)piperazin-1-yl]sulfonylthiophene-3-carboxylate CAS Name: 5-[[4-[(2,2-dichloro-1-methylcyclopropyl)-oxomethyl]-1-piperazinyl]sulfonyl]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[4-(2,2-dichloro-1-methylcyclopropanecarbonyl)piperazin-1-yl]sulfonylthiophene-3-carboxylate Traditional Name: 5-[4-(2,2-dichloro-1-methyl-cyclopropanecarbonyl)piperazino]sulfonylthiophene-3-carboxylic acid methyl ester Formula: C15H18Cl2N2O5S2 MolecularWeight: 441.34982

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC1(Cl)Cl)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=CS3)C(=O)OC

Isomeric SMILES

CC1(CC1(Cl)Cl)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=CS3)C(=O)OC

InChI

InChI=1S/C15H18Cl2N2O5S2/c1-14(9-15(14,16)17)13(21)18-3-5-19(6-4-18)26(22,23)11-7-10(8-25-11)12(20)24-2/h7-8H,3-6,9H2,1-2H3