2-(oxan-4-ylmethylsulfanyl)-1H-benzimidazole

Systemtic Name: 2-(oxan-4-ylmethylsulfanyl)-1H-benzimidazole Openeye Name: 2-(tetrahydropyran-4-ylmethylsulfanyl)-1H-benzimidazole CAS Name: 2-(4-oxanylmethylthio)-1H-benzimidazole IUPAC Name: 2-(oxan-4-ylmethylsulfanyl)-1H-benzimidazole Traditional Name: 2-(tetrahydropyran-4-ylmethylthio)-1H-benzimidazole Formula: C13H16N2OS MolecularWeight: 248.34394

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1CSC2=NC3=CC=CC=C3N2

Isomeric SMILES

C1COCCC1CSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C13H16N2OS/c1-2-4-12-11(3-1)14-13(15-12)17-9-10-5-7-16-8-6-10/h1-4,10H,5-9H2,(H,14,15)