2-[(4-methoxy-3-methyl-pyridin-2-yl)methylsulfanyl]-6-(4-methylpiperazin-1-yl)-1H-benzimidazole

Systemtic Name: 2-[(4-methoxy-3-methyl-pyridin-2-yl)methylsulfanyl]-6-(4-methylpiperazin-1-yl)-1H-benzimidazole Openeye Name: 2-[(4-methoxy-3-methyl-2-pyridyl)methylsulfanyl]-6-(4-methylpiperazin-1-yl)-1H-benzimidazole CAS Name: 2-[(4-methoxy-3-methyl-2-pyridinyl)methylthio]-6-(4-methyl-1-piperazinyl)-1H-benzimidazole IUPAC Name: 2-[(4-methoxy-3-methylpyridin-2-yl)methylsulfanyl]-6-(4-methylpiperazin-1-yl)-1H-benzimidazole Traditional Name: 2-[(4-methoxy-3-methyl-2-pyridyl)methylthio]-6-(4-methylpiperazino)-1H-benzimidazole Formula: C20H25N5OS MolecularWeight: 383.5104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1CSC2=NC3=C(N2)C=C(C=C3)N4CCN(CC4)C)OC

Isomeric SMILES

CC1=C(C=CN=C1CSC2=NC3=C(N2)C=C(C=C3)N4CCN(CC4)C)OC

InChI

InChI=1S/C20H25N5OS/c1-14-18(21-7-6-19(14)26-3)13-27-20-22-16-5-4-15(12-17(16)23-20)25-10-8-24(2)9-11-25/h4-7,12H,8-11,13H2,1-3H3,(H,22,23)