1-[(3,4-dichlorophenyl)methylsulfonyl]-N-[4-(phenylsulfanylmethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-[(3,4-dichlorophenyl)methylsulfonyl]-N-[4-(phenylsulfanylmethyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-[(3,4-dichlorophenyl)methylsulfonyl]-N-[4-(phenylsulfanylmethyl)phenyl]piperidine-4-carboxamide CAS Name: 1-[(3,4-dichlorophenyl)methylsulfonyl]-N-[4-[(phenylthio)methyl]phenyl]-4-piperidinecarboxamide IUPAC Name: 1-[(3,4-dichlorophenyl)methylsulfonyl]-N-[4-(phenylsulfanylmethyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-(3,4-dichlorobenzyl)sulfonyl-N-[4-[(phenylthio)methyl]phenyl]isonipecotamide Formula: C26H26Cl2N2O3S2 MolecularWeight: 549.53224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=C(C=C2)CSC3=CC=CC=C3)S(=O)(=O)CC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=C(C=C2)CSC3=CC=CC=C3)S(=O)(=O)CC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C26H26Cl2N2O3S2/c27-24-11-8-20(16-25(24)28)18-35(32,33)30-14-12-21(13-15-30)26(31)29-22-9-6-19(7-10-22)17-34-23-4-2-1-3-5-23/h1-11,16,21H,12-15,17-18H2,(H,29,31)