5,6-dimethyl-2-[2-(pyridin-3-ylmethylsulfanyl)pyridin-3-yl]-1H-benzimidazole

Systemtic Name: 5,6-dimethyl-2-[2-(pyridin-3-ylmethylsulfanyl)pyridin-3-yl]-1H-benzimidazole Openeye Name: 5,6-dimethyl-2-[2-(3-pyridylmethylsulfanyl)-3-pyridyl]-1H-benzimidazole CAS Name: 5,6-dimethyl-2-[2-(3-pyridinylmethylthio)-3-pyridinyl]-1H-benzimidazole IUPAC Name: 5,6-dimethyl-2-[2-(pyridin-3-ylmethylsulfanyl)pyridin-3-yl]-1H-benzimidazole Traditional Name: 5,6-dimethyl-2-[2-(3-pyridylmethylthio)-3-pyridyl]-1H-benzimidazole Formula: C20H18N4S MolecularWeight: 346.44872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(N2)C3=C(N=CC=C3)SCC4=CN=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(N2)C3=C(N=CC=C3)SCC4=CN=CC=C4

InChI

InChI=1S/C20H18N4S/c1-13-9-17-18(10-14(13)2)24-19(23-17)16-6-4-8-22-20(16)25-12-15-5-3-7-21-11-15/h3-11H,12H2,1-2H3,(H,23,24)