3-(4-piperidin-1-ylsulfonylphenyl)-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]propanamide

Systemtic Name: 3-(4-piperidin-1-ylsulfonylphenyl)-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]propanamide Openeye Name: 3-[4-(1-piperidylsulfonyl)phenyl]-N-[2-(2-thienylmethylsulfanyl)ethyl]propanamide CAS Name: 3-[4-(1-piperidinylsulfonyl)phenyl]-N-[2-(thiophen-2-ylmethylthio)ethyl]propanamide IUPAC Name: 3-(4-piperidin-1-ylsulfonylphenyl)-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]propanamide Traditional Name: 3-(4-piperidinosulfonylphenyl)-N-[2-(2-thenylthio)ethyl]propionamide Formula: C21H28N2O3S3 MolecularWeight: 452.65362

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NCCSCC3=CC=CS3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NCCSCC3=CC=CS3

InChI

InChI=1S/C21H28N2O3S3/c24-21(22-12-16-27-17-19-5-4-15-28-19)11-8-18-6-9-20(10-7-18)29(25,26)23-13-2-1-3-14-23/h4-7,9-10,15H,1-3,8,11-14,16-17H2,(H,22,24)