2-[2-[(3-methyl-1-methylsulfanyl-2-pyridin-2-yl-2H-benzimidazol-4-yl)oxy]ethyl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[2-[(3-methyl-1-methylsulfanyl-2-pyridin-2-yl-2H-benzimidazol-4-yl)oxy]ethyl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[2-[[3-methyl-1-methylsulfanyl-2-(2-pyridyl)-2H-benzimidazol-4-yl]oxy]ethyl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[2-[[3-methyl-1-(methylthio)-2-(2-pyridinyl)-2H-benzimidazol-4-yl]oxy]ethyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[2-[(3-methyl-1-methylsulfanyl-2-pyridin-2-yl-2H-benzimidazol-4-yl)oxy]ethyl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[2-[[3-methyl-1-(methylthio)-2-(2-pyridyl)-2H-benzimidazol-4-yl]oxy]ethyl]-3,4-dihydro-1H-isoquinoline Formula: C25H28N4OS MolecularWeight: 432.58102

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(N(C2=C1C(=CC=C2)OCCN3CCC4=CC=CC=C4C3)SC)C5=CC=CC=N5

Isomeric SMILES

CN1C(N(C2=C1C(=CC=C2)OCCN3CCC4=CC=CC=C4C3)SC)C5=CC=CC=N5

InChI

InChI=1S/C25H28N4OS/c1-27-24-22(29(31-2)25(27)21-10-5-6-14-26-21)11-7-12-23(24)30-17-16-28-15-13-19-8-3-4-9-20(19)18-28/h3-12,14,25H,13,15-18H2,1-2H3