2-[[3-methyl-4-[1-(phenylmethylsulfanyl)ethoxy]pyridin-2-yl]methylsulfanyl]-1H-benzimidazole

Systemtic Name: 2-[[3-methyl-4-[1-(phenylmethylsulfanyl)ethoxy]pyridin-2-yl]methylsulfanyl]-1H-benzimidazole Openeye Name: 2-[[4-(1-benzylsulfanylethoxy)-3-methyl-2-pyridyl]methylsulfanyl]-1H-benzimidazole CAS Name: 2-[[3-methyl-4-[1-(phenylmethylthio)ethoxy]-2-pyridinyl]methylthio]-1H-benzimidazole IUPAC Name: 2-[[4-(1-benzylsulfanylethoxy)-3-methylpyridin-2-yl]methylsulfanyl]-1H-benzimidazole Traditional Name: 2-[[4-[1-(benzylthio)ethoxy]-3-methyl-2-pyridyl]methylthio]-1H-benzimidazole Formula: C23H23N3OS2 MolecularWeight: 421.57822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1CSC2=NC3=CC=CC=C3N2)OC(C)SCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CN=C1CSC2=NC3=CC=CC=C3N2)OC(C)SCC4=CC=CC=C4

InChI

InChI=1S/C23H23N3OS2/c1-16-21(15-29-23-25-19-10-6-7-11-20(19)26-23)24-13-12-22(16)27-17(2)28-14-18-8-4-3-5-9-18/h3-13,17H,14-15H2,1-2H3,(H,25,26)