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

Systemtic Name: ethyl 5-[[1-(4-chlorophenyl)sulfonylpiperidin-3-yl]carbonylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[[1-(4-chlorophenyl)sulfonylpiperidine-3-carbonyl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[[1-(4-chlorophenyl)sulfonyl-3-piperidinyl]-oxomethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[1-(4-chlorophenyl)sulfonylpiperidine-3-carbonyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 5-[[1-(4-chlorophenyl)sulfonylnipecotoyl]amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C20H23ClN2O5S2 MolecularWeight: 470.99002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23ClN2O5S2/c1-3-28-20(25)18-13(2)11-17(29-18)22-19(24)14-5-4-10-23(12-14)30(26,27)16-8-6-15(21)7-9-16/h6-9,11,14H,3-5,10,12H2,1-2H3,(H,22,24)