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

Systemtic Name: ethyl 3-[[1-(4-chlorophenyl)sulfonylpiperidin-3-yl]carbonylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-[[1-(4-chlorophenyl)sulfonylpiperidine-3-carbonyl]amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[[1-(4-chlorophenyl)sulfonyl-3-piperidinyl]-oxomethyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[1-(4-chlorophenyl)sulfonylpiperidine-3-carbonyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[1-(4-chlorophenyl)sulfonylnipecotoyl]amino]-5-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C25H25ClN2O5S2 MolecularWeight: 533.0594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H25ClN2O5S2/c1-2-33-25(30)23-21(15-22(34-23)17-7-4-3-5-8-17)27-24(29)18-9-6-14-28(16-18)35(31,32)20-12-10-19(26)11-13-20/h3-5,7-8,10-13,15,18H,2,6,9,14,16H2,1H3,(H,27,29)