1-[(2,4-dichlorophenyl)methylsulfonyl]-N-[2-(4-methylphenyl)sulfanylethyl]piperidine-3-carboxamide

Systemtic Name: 1-[(2,4-dichlorophenyl)methylsulfonyl]-N-[2-(4-methylphenyl)sulfanylethyl]piperidine-3-carboxamide Openeye Name: 1-[(2,4-dichlorophenyl)methylsulfonyl]-N-[2-(p-tolylsulfanyl)ethyl]piperidine-3-carboxamide CAS Name: 1-[(2,4-dichlorophenyl)methylsulfonyl]-N-[2-[(4-methylphenyl)thio]ethyl]-3-piperidinecarboxamide IUPAC Name: 1-[(2,4-dichlorophenyl)methylsulfonyl]-N-[2-(4-methylphenyl)sulfanylethyl]piperidine-3-carboxamide Traditional Name: 1-(2,4-dichlorobenzyl)sulfonyl-N-[2-(p-tolylthio)ethyl]nipecotamide Formula: C22H26Cl2N2O3S2 MolecularWeight: 501.48944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C2CCCN(C2)S(=O)(=O)CC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)C2CCCN(C2)S(=O)(=O)CC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H26Cl2N2O3S2/c1-16-4-8-20(9-5-16)30-12-10-25-22(27)17-3-2-11-26(14-17)31(28,29)15-18-6-7-19(23)13-21(18)24/h4-9,13,17H,2-3,10-12,14-15H2,1H3,(H,25,27)