2-[2-(4-methylphenyl)sulfonylethylsulfanyl]-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide

Systemtic Name: 2-[2-(4-methylphenyl)sulfonylethylsulfanyl]-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide Openeye Name: 2-[2-(p-tolylsulfonyl)ethylsulfanyl]-N-(2-thienylmethyl)pyridine-3-carboxamide CAS Name: 2-[2-(4-methylphenyl)sulfonylethylthio]-N-(thiophen-2-ylmethyl)-3-pyridinecarboxamide IUPAC Name: 2-[2-(4-methylphenyl)sulfonylethylsulfanyl]-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide Traditional Name: N-(2-thenyl)-2-(2-tosylethylthio)nicotinamide Formula: C20H20N2O3S3 MolecularWeight: 432.5794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCSC2=C(C=CC=N2)C(=O)NCC3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCSC2=C(C=CC=N2)C(=O)NCC3=CC=CS3

InChI

InChI=1S/C20H20N2O3S3/c1-15-6-8-17(9-7-15)28(24,25)13-12-27-20-18(5-2-10-21-20)19(23)22-14-16-4-3-11-26-16/h2-11H,12-14H2,1H3,(H,22,23)