N-(2-ethylsulfanylphenyl)-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(2-ethylsulfanylphenyl)-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-(2-ethylsulfanylphenyl)-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: N-[2-(ethylthio)phenyl]-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-(2-ethylsulfanylphenyl)-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-[2-(ethylthio)phenyl]-1-(2-thienylsulfonyl)nipecotamide Formula: C18H22N2O3S3 MolecularWeight: 410.57388

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCSC1=CC=CC=C1NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H22N2O3S3/c1-2-24-16-9-4-3-8-15(16)19-18(21)14-7-5-11-20(13-14)26(22,23)17-10-6-12-25-17/h3-4,6,8-10,12,14H,2,5,7,11,13H2,1H3,(H,19,21)