4-[2-(4-chlorophenyl)ethyl]-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: 4-[2-(4-chlorophenyl)ethyl]-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: 4-[2-(4-chlorophenyl)ethyl]-2-(4-pyridylmethylsulfanyl)pyridine-3-carboxamide CAS Name: 4-[2-(4-chlorophenyl)ethyl]-2-(pyridin-4-ylmethylthio)-3-pyridinecarboxamide IUPAC Name: 4-[2-(4-chlorophenyl)ethyl]-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide Traditional Name: 4-[2-(4-chlorophenyl)ethyl]-2-(4-pyridylmethylthio)nicotinamide Formula: C20H18ClN3OS MolecularWeight: 383.89442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC2=C(C(=NC=C2)SCC3=CC=NC=C3)C(=O)N)Cl

Isomeric SMILES

C1=CC(=CC=C1CCC2=C(C(=NC=C2)SCC3=CC=NC=C3)C(=O)N)Cl

InChI

InChI=1S/C20H18ClN3OS/c21-17-5-2-14(3-6-17)1-4-16-9-12-24-20(18(16)19(22)25)26-13-15-7-10-23-11-8-15/h2-3,5-12H,1,4,13H2,(H2,22,25)