N-[2-[3-(benzimidazol-1-ylmethyl)-2-methyl-phenyl]sulfanylethyl]-N-methyl-2-pyridin-2-yl-ethanamine

Systemtic Name: N-[2-[3-(benzimidazol-1-ylmethyl)-2-methyl-phenyl]sulfanylethyl]-N-methyl-2-pyridin-2-yl-ethanamine Openeye Name: N-[2-[3-(benzimidazol-1-ylmethyl)-2-methyl-phenyl]sulfanylethyl]-N-methyl-2-(2-pyridyl)ethanamine CAS Name: N-[2-[[3-(1-benzimidazolylmethyl)-2-methylphenyl]thio]ethyl]-N-methyl-2-(2-pyridinyl)ethanamine IUPAC Name: N-[2-[3-(benzimidazol-1-ylmethyl)-2-methylphenyl]sulfanylethyl]-N-methyl-2-pyridin-2-ylethanamine Traditional Name: 2-[[3-(benzimidazol-1-ylmethyl)-2-methyl-phenyl]thio]ethyl-methyl-[2-(2-pyridyl)ethyl]amine Formula: C25H28N4S MolecularWeight: 416.58162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1SCCN(C)CCC2=CC=CC=N2)CN3C=NC4=CC=CC=C43

Isomeric SMILES

CC1=C(C=CC=C1SCCN(C)CCC2=CC=CC=N2)CN3C=NC4=CC=CC=C43

InChI

InChI=1S/C25H28N4S/c1-20-21(18-29-19-27-23-10-3-4-11-24(23)29)8-7-12-25(20)30-17-16-28(2)15-13-22-9-5-6-14-26-22/h3-12,14,19H,13,15-18H2,1-2H3