1-[[2-methyl-3-(2-pyridin-4-ylsulfanylethylsulfanyl)phenyl]methyl]benzimidazole

Systemtic Name: 1-[[2-methyl-3-(2-pyridin-4-ylsulfanylethylsulfanyl)phenyl]methyl]benzimidazole Openeye Name: 1-[[2-methyl-3-[2-(4-pyridylsulfanyl)ethylsulfanyl]phenyl]methyl]benzimidazole CAS Name: 1-[[2-methyl-3-[2-(pyridin-4-ylthio)ethylthio]phenyl]methyl]benzimidazole IUPAC Name: 1-[[2-methyl-3-(2-pyridin-4-ylsulfanylethylsulfanyl)phenyl]methyl]benzimidazole Traditional Name: 1-[2-methyl-3-[2-(4-pyridylthio)ethylthio]benzyl]benzimidazole Formula: C22H21N3S2 MolecularWeight: 391.55224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1SCCSC2=CC=NC=C2)CN3C=NC4=CC=CC=C43

Isomeric SMILES

CC1=C(C=CC=C1SCCSC2=CC=NC=C2)CN3C=NC4=CC=CC=C43

InChI

InChI=1S/C22H21N3S2/c1-17-18(15-25-16-24-20-6-2-3-7-21(20)25)5-4-8-22(17)27-14-13-26-19-9-11-23-12-10-19/h2-12,16H,13-15H2,1H3