2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-N-[2-(phenylmethylsulfanyl)ethyl]pyridine-3-carboxamide

Systemtic Name: 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-N-[2-(phenylmethylsulfanyl)ethyl]pyridine-3-carboxamide Openeye Name: N-(2-benzylsulfanylethyl)-2-[(5-methylisoxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide CAS Name: 2-[(5-methyl-3-isoxazolyl)methylthio]-N-[2-(phenylmethylthio)ethyl]-3-pyridinecarboxamide IUPAC Name: N-(2-benzylsulfanylethyl)-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide Traditional Name: N-[2-(benzylthio)ethyl]-2-[(5-methylisoxazol-3-yl)methylthio]nicotinamide Formula: C20H21N3O2S2 MolecularWeight: 399.52964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CSC2=C(C=CC=N2)C(=O)NCCSCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=NO1)CSC2=C(C=CC=N2)C(=O)NCCSCC3=CC=CC=C3

InChI

InChI=1S/C20H21N3O2S2/c1-15-12-17(23-25-15)14-27-20-18(8-5-9-22-20)19(24)21-10-11-26-13-16-6-3-2-4-7-16/h2-9,12H,10-11,13-14H2,1H3,(H,21,24)