2-(2-pyridin-4-ylethylsulfanyl)-1H-benzimidazole

Systemtic Name: 2-(2-pyridin-4-ylethylsulfanyl)-1H-benzimidazole Openeye Name: 2-[2-(4-pyridyl)ethylsulfanyl]-1H-benzimidazole CAS Name: 2-(2-pyridin-4-ylethylthio)-1H-benzimidazole IUPAC Name: 2-(2-pyridin-4-ylethylsulfanyl)-1H-benzimidazole Traditional Name: 2-[2-(4-pyridyl)ethylthio]-1H-benzimidazole Formula: C14H13N3S MolecularWeight: 255.33812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SCCC3=CC=NC=C3

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SCCC3=CC=NC=C3

InChI

InChI=1S/C14H13N3S/c1-2-4-13-12(3-1)16-14(17-13)18-10-7-11-5-8-15-9-6-11/h1-6,8-9H,7,10H2,(H,16,17)