2-(phenylmethylsulfanyl)-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide

Systemtic Name: 2-(phenylmethylsulfanyl)-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide Openeye Name: 2-benzylsulfanyl-N-[2-(4-pyridyl)ethyl]pyridine-3-carboxamide CAS Name: 2-(phenylmethylthio)-N-(2-pyridin-4-ylethyl)-3-pyridinecarboxamide IUPAC Name: 2-benzylsulfanyl-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide Traditional Name: 2-(benzylthio)-N-[2-(4-pyridyl)ethyl]nicotinamide Formula: C20H19N3OS MolecularWeight: 349.44936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=C(C=CC=N2)C(=O)NCCC3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C=C1)CSC2=C(C=CC=N2)C(=O)NCCC3=CC=NC=C3

InChI

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