2-[(2-chlorophenyl)methylsulfanyl]-N-phenethyl-pyridine-3-carboxamide

Systemtic Name: 2-[(2-chlorophenyl)methylsulfanyl]-N-phenethyl-pyridine-3-carboxamide Openeye Name: 2-[(2-chlorophenyl)methylsulfanyl]-N-phenethyl-pyridine-3-carboxamide CAS Name: 2-[(2-chlorophenyl)methylthio]-N-phenethyl-3-pyridinecarboxamide IUPAC Name: 2-[(2-chlorophenyl)methylsulfanyl]-N-phenethylpyridine-3-carboxamide Traditional Name: 2-[(2-chlorobenzyl)thio]-N-phenethyl-nicotinamide Formula: C21H19ClN2OS MolecularWeight: 382.90636

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C2=C(N=CC=C2)SCC3=CC=CC=C3Cl

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C2=C(N=CC=C2)SCC3=CC=CC=C3Cl

InChI

InChI=1S/C21H19ClN2OS/c22-19-11-5-4-9-17(19)15-26-21-18(10-6-13-24-21)20(25)23-14-12-16-7-2-1-3-8-16/h1-11,13H,12,14-15H2,(H,23,25)