N-[2-[(3-chlorophenyl)methylsulfanyl]ethyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-[(3-chlorophenyl)methylsulfanyl]ethyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-[(3-chlorophenyl)methylsulfanyl]ethyl]-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-[(3-chlorophenyl)methylthio]ethyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-[(3-chlorophenyl)methylsulfanyl]ethyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[2-[(3-chlorobenzyl)thio]ethyl]-1-(2-thienylsulfonyl)isonipecotamide Formula: C19H23ClN2O3S3 MolecularWeight: 459.04552

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCSCC2=CC(=CC=C2)Cl)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CCC1C(=O)NCCSCC2=CC(=CC=C2)Cl)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C19H23ClN2O3S3/c20-17-4-1-3-15(13-17)14-26-12-8-21-19(23)16-6-9-22(10-7-16)28(24,25)18-5-2-11-27-18/h1-5,11,13,16H,6-10,12,14H2,(H,21,23)