ethyl 1-[3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]phenyl]sulfonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]phenyl]sulfonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[3-[2-(4-chlorophenyl)thiazol-4-yl]phenyl]sulfonylpiperidine-4-carboxylate CAS Name: 1-[3-[2-(4-chlorophenyl)-4-thiazolyl]phenyl]sulfonyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]phenyl]sulfonylpiperidine-4-carboxylate Traditional Name: 1-[3-[2-(4-chlorophenyl)thiazol-4-yl]phenyl]sulfonylisonipecotic acid ethyl ester Formula: C23H23ClN2O4S2 MolecularWeight: 491.02272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C3=CSC(=N3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C3=CSC(=N3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H23ClN2O4S2/c1-2-30-23(27)17-10-12-26(13-11-17)32(28,29)20-5-3-4-18(14-20)21-15-31-22(25-21)16-6-8-19(24)9-7-16/h3-9,14-15,17H,2,10-13H2,1H3