N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(2-methylsulfanylimidazol-1-yl)benzamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(2-methylsulfanylimidazol-1-yl)benzamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(2-methylsulfanylimidazol-1-yl)benzamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-3-[2-(methylthio)-1-imidazolyl]benzamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(2-methylsulfanylimidazol-1-yl)benzamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-3-[2-(methylthio)imidazol-1-yl]benzamide Formula: C21H20N4OS2 MolecularWeight: 408.5397

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=CN1C2=CC=CC(=C2)C(=O)NCCSCC3=CC=CC=C3C#N

Isomeric SMILES

CSC1=NC=CN1C2=CC=CC(=C2)C(=O)NCCSCC3=CC=CC=C3C#N

InChI

InChI=1S/C21H20N4OS2/c1-27-21-24-9-11-25(21)19-8-4-7-16(13-19)20(26)23-10-12-28-15-18-6-3-2-5-17(18)14-22/h2-9,11,13H,10,12,15H2,1H3,(H,23,26)