methyl 5-[[1-(4-chlorophenyl)sulfonylpiperidin-3-yl]carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 5-[[1-(4-chlorophenyl)sulfonylpiperidin-3-yl]carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 5-[[1-(4-chlorophenyl)sulfonylpiperidine-3-carbonyl]amino]thiophene-2-carboxylate CAS Name: 5-[[[1-(4-chlorophenyl)sulfonyl-3-piperidinyl]-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[[1-(4-chlorophenyl)sulfonylpiperidine-3-carbonyl]amino]thiophene-2-carboxylate Traditional Name: 5-[[1-(4-chlorophenyl)sulfonylnipecotoyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C18H19ClN2O5S2 MolecularWeight: 442.93686

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(S1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=CC=C(S1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H19ClN2O5S2/c1-26-18(23)15-8-9-16(27-15)20-17(22)12-3-2-10-21(11-12)28(24,25)14-6-4-13(19)5-7-14/h4-9,12H,2-3,10-11H2,1H3,(H,20,22)