N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-6-methyl-pyridine-3-carboxamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-6-methyl-pyridine-3-carboxamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-6-methyl-pyridine-3-carboxamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-6-methyl-3-pyridinecarboxamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-6-methylpyridine-3-carboxamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-6-methyl-nicotinamide Formula: C17H17N3OS MolecularWeight: 311.40138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)C(=O)NCCSCC2=CC=CC=C2C#N

Isomeric SMILES

CC1=NC=C(C=C1)C(=O)NCCSCC2=CC=CC=C2C#N

InChI

InChI=1S/C17H17N3OS/c1-13-6-7-15(11-20-13)17(21)19-8-9-22-12-16-5-3-2-4-14(16)10-18/h2-7,11H,8-9,12H2,1H3,(H,19,21)