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

Systemtic Name: 1-[(2,4-dichlorophenyl)methylsulfonyl]-N-(2-phenylsulfanylethyl)piperidine-3-carboxamide Openeye Name: 1-[(2,4-dichlorophenyl)methylsulfonyl]-N-(2-phenylsulfanylethyl)piperidine-3-carboxamide CAS Name: 1-[(2,4-dichlorophenyl)methylsulfonyl]-N-[2-(phenylthio)ethyl]-3-piperidinecarboxamide IUPAC Name: 1-[(2,4-dichlorophenyl)methylsulfonyl]-N-(2-phenylsulfanylethyl)piperidine-3-carboxamide Traditional Name: 1-(2,4-dichlorobenzyl)sulfonyl-N-[2-(phenylthio)ethyl]nipecotamide Formula: C21H24Cl2N2O3S2 MolecularWeight: 487.46286

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)CC2=C(C=C(C=C2)Cl)Cl)C(=O)NCCSC3=CC=CC=C3

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)CC2=C(C=C(C=C2)Cl)Cl)C(=O)NCCSC3=CC=CC=C3

InChI

InChI=1S/C21H24Cl2N2O3S2/c22-18-9-8-17(20(23)13-18)15-30(27,28)25-11-4-5-16(14-25)21(26)24-10-12-29-19-6-2-1-3-7-19/h1-3,6-9,13,16H,4-5,10-12,14-15H2,(H,24,26)