2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-chloranyl-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-N-methyl-pyridin-4-amine

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-chloranyl-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-N-methyl-pyridin-4-amine Openeye Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-chloro-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-N-methyl-pyridin-4-amine CAS Name: 2-[(1H-benzimidazol-2-ylthio)methyl]-3-chloro-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-N-methyl-4-pyridinamine IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-chloro-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-N-methylpyridin-4-amine Traditional Name: [2-[(1H-benzimidazol-2-ylthio)methyl]-3-chloro-4-pyridyl]-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-methyl-amine Formula: C26H28ClN5S MolecularWeight: 478.05202

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCN1CCC2=CC=CC=C2C1)C3=C(C(=NC=C3)CSC4=NC5=CC=CC=C5N4)Cl

Isomeric SMILES

CN(CCCN1CCC2=CC=CC=C2C1)C3=C(C(=NC=C3)CSC4=NC5=CC=CC=C5N4)Cl

InChI

InChI=1S/C26H28ClN5S/c1-31(14-6-15-32-16-12-19-7-2-3-8-20(19)17-32)24-11-13-28-23(25(24)27)18-33-26-29-21-9-4-5-10-22(21)30-26/h2-5,7-11,13H,6,12,14-18H2,1H3,(H,29,30)