N-[2-[2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-methyl-pyridin-4-yl]oxyethyl]-N-(phenylmethyl)cyclohexanamine

Systemtic Name: N-[2-[2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-methyl-pyridin-4-yl]oxyethyl]-N-(phenylmethyl)cyclohexanamine Openeye Name: N-[2-[[2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-methyl-4-pyridyl]oxy]ethyl]-N-benzyl-cyclohexanamine CAS Name: N-[2-[[2-[(1H-benzimidazol-2-ylthio)methyl]-3-methyl-4-pyridinyl]oxy]ethyl]-N-(phenylmethyl)cyclohexanamine IUPAC Name: N-[2-[2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-methylpyridin-4-yl]oxyethyl]-N-benzylcyclohexanamine Traditional Name: 2-[[2-[(1H-benzimidazol-2-ylthio)methyl]-3-methyl-4-pyridyl]oxy]ethyl-benzyl-cyclohexyl-amine Formula: C29H34N4OS MolecularWeight: 486.67146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1CSC2=NC3=CC=CC=C3N2)OCCN(CC4=CC=CC=C4)C5CCCCC5

Isomeric SMILES

CC1=C(C=CN=C1CSC2=NC3=CC=CC=C3N2)OCCN(CC4=CC=CC=C4)C5CCCCC5

InChI

InChI=1S/C29H34N4OS/c1-22-27(21-35-29-31-25-14-8-9-15-26(25)32-29)30-17-16-28(22)34-19-18-33(24-12-6-3-7-13-24)20-23-10-4-2-5-11-23/h2,4-5,8-11,14-17,24H,3,6-7,12-13,18-21H2,1H3,(H,31,32)