6-(phenylmethylsulfanyl)-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide

Systemtic Name: 6-(phenylmethylsulfanyl)-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide Openeye Name: 6-benzylsulfanyl-N-[2-(2-pyridyl)ethyl]pyridine-3-carboxamide CAS Name: 6-(phenylmethylthio)-N-[2-(2-pyridinyl)ethyl]-3-pyridinecarboxamide IUPAC Name: 6-benzylsulfanyl-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide Traditional Name: 6-(benzylthio)-N-[2-(2-pyridyl)ethyl]nicotinamide Formula: C20H19N3OS MolecularWeight: 349.44936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC=C(C=C2)C(=O)NCCC3=CC=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC=C(C=C2)C(=O)NCCC3=CC=CC=N3

InChI

InChI=1S/C20H19N3OS/c24-20(22-13-11-18-8-4-5-12-21-18)17-9-10-19(23-14-17)25-15-16-6-2-1-3-7-16/h1-10,12,14H,11,13,15H2,(H,22,24)