2-methylsulfanyl-N-[2-(1-thiophen-2-ylsulfonylpiperidin-2-yl)ethyl]pyridine-3-carboxamide

Systemtic Name: 2-methylsulfanyl-N-[2-(1-thiophen-2-ylsulfonylpiperidin-2-yl)ethyl]pyridine-3-carboxamide Openeye Name: 2-methylsulfanyl-N-[2-[1-(2-thienylsulfonyl)-2-piperidyl]ethyl]pyridine-3-carboxamide CAS Name: 2-(methylthio)-N-[2-(1-thiophen-2-ylsulfonyl-2-piperidinyl)ethyl]-3-pyridinecarboxamide IUPAC Name: 2-methylsulfanyl-N-[2-(1-thiophen-2-ylsulfonylpiperidin-2-yl)ethyl]pyridine-3-carboxamide Traditional Name: 2-(methylthio)-N-[2-[1-(2-thienylsulfonyl)-2-piperidyl]ethyl]nicotinamide Formula: C18H23N3O3S3 MolecularWeight: 425.58852

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)NCCC2CCCCN2S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)NCCC2CCCCN2S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H23N3O3S3/c1-25-18-15(7-4-10-20-18)17(22)19-11-9-14-6-2-3-12-21(14)27(23,24)16-8-5-13-26-16/h4-5,7-8,10,13-14H,2-3,6,9,11-12H2,1H3,(H,19,22)