2-methylsulfanyl-N-[2-(phenylmethylsulfanyl)ethyl]pyridine-3-carboxamide

Systemtic Name: 2-methylsulfanyl-N-[2-(phenylmethylsulfanyl)ethyl]pyridine-3-carboxamide Openeye Name: N-(2-benzylsulfanylethyl)-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: 2-(methylthio)-N-[2-(phenylmethylthio)ethyl]-3-pyridinecarboxamide IUPAC Name: N-(2-benzylsulfanylethyl)-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-[2-(benzylthio)ethyl]-2-(methylthio)nicotinamide Formula: C16H18N2OS2 MolecularWeight: 318.45692

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)NCCSCC2=CC=CC=C2

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)NCCSCC2=CC=CC=C2

InChI

InChI=1S/C16H18N2OS2/c1-20-16-14(8-5-9-18-16)15(19)17-10-11-21-12-13-6-3-2-4-7-13/h2-9H,10-12H2,1H3,(H,17,19)