1-hexyl-2-[phenyl(phenylsulfanyl)methyl]benzimidazole

Systemtic Name: 1-hexyl-2-[phenyl(phenylsulfanyl)methyl]benzimidazole Openeye Name: 1-hexyl-2-[phenyl(phenylsulfanyl)methyl]benzimidazole CAS Name: 1-hexyl-2-[phenyl-(phenylthio)methyl]benzimidazole IUPAC Name: 1-hexyl-2-[phenyl(phenylsulfanyl)methyl]benzimidazole Traditional Name: 1-hexyl-2-[phenyl-(phenylthio)methyl]benzimidazole Formula: C26H28N2S MolecularWeight: 400.57892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2N=C1C(C3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2N=C1C(C3=CC=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C26H28N2S/c1-2-3-4-13-20-28-24-19-12-11-18-23(24)27-26(28)25(21-14-7-5-8-15-21)29-22-16-9-6-10-17-22/h5-12,14-19,25H,2-4,13,20H2,1H3