6-methyl-2-(pyridin-3-ylmethylsulfanyl)-1H-benzimidazole

Systemtic Name: 6-methyl-2-(pyridin-3-ylmethylsulfanyl)-1H-benzimidazole Openeye Name: 6-methyl-2-(3-pyridylmethylsulfanyl)-1H-benzimidazole CAS Name: 6-methyl-2-(3-pyridinylmethylthio)-1H-benzimidazole IUPAC Name: 6-methyl-2-(pyridin-3-ylmethylsulfanyl)-1H-benzimidazole Traditional Name: 6-methyl-2-(3-pyridylmethylthio)-1H-benzimidazole Formula: C14H13N3S MolecularWeight: 255.33812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)SCC3=CN=CC=C3

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)SCC3=CN=CC=C3

InChI

InChI=1S/C14H13N3S/c1-10-4-5-12-13(7-10)17-14(16-12)18-9-11-3-2-6-15-8-11/h2-8H,9H2,1H3,(H,16,17)