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

Systemtic Name: 1-[[2-methyl-3-(2-pyrimidin-2-ylsulfanylethylsulfanyl)phenyl]methyl]benzimidazole Openeye Name: 1-[[2-methyl-3-(2-pyrimidin-2-ylsulfanylethylsulfanyl)phenyl]methyl]benzimidazole CAS Name: 1-[[2-methyl-3-[2-(2-pyrimidinylthio)ethylthio]phenyl]methyl]benzimidazole IUPAC Name: 1-[[2-methyl-3-(2-pyrimidin-2-ylsulfanylethylsulfanyl)phenyl]methyl]benzimidazole Traditional Name: 1-[2-methyl-3-[2-(2-pyrimidylthio)ethylthio]benzyl]benzimidazole Formula: C21H20N4S2 MolecularWeight: 392.5403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1SCCSC2=NC=CC=N2)CN3C=NC4=CC=CC=C43

Isomeric SMILES

CC1=C(C=CC=C1SCCSC2=NC=CC=N2)CN3C=NC4=CC=CC=C43

InChI

InChI=1S/C21H20N4S2/c1-16-17(14-25-15-24-18-7-2-3-8-19(18)25)6-4-9-20(16)26-12-13-27-21-22-10-5-11-23-21/h2-11,15H,12-14H2,1H3