3-chloranyl-N-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propyl]-N-methyl-2-(1-methylsulfanylbenzimidazol-2-yl)pyridin-4-amine

Systemtic Name: 3-chloranyl-N-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propyl]-N-methyl-2-(1-methylsulfanylbenzimidazol-2-yl)pyridin-4-amine Openeye Name: 3-chloro-N-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propyl]-N-methyl-2-(1-methylsulfanylbenzimidazol-2-yl)pyridin-4-amine CAS Name: 3-chloro-N-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propyl]-N-methyl-2-[1-(methylthio)-2-benzimidazolyl]-4-pyridinamine IUPAC Name: 3-chloro-N-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propyl]-N-methyl-2-(1-methylsulfanylbenzimidazol-2-yl)pyridin-4-amine Traditional Name: [3-chloro-2-[1-(methylthio)benzimidazol-2-yl]-4-pyridyl]-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propyl]-methyl-amine Formula: C28H32ClN5O2S MolecularWeight: 538.10398

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCN1CCC2=CC(=C(C=C2C1)OC)OC)C3=C(C(=NC=C3)C4=NC5=CC=CC=C5N4SC)Cl

Isomeric SMILES

CN(CCCN1CCC2=CC(=C(C=C2C1)OC)OC)C3=C(C(=NC=C3)C4=NC5=CC=CC=C5N4SC)Cl

InChI

InChI=1S/C28H32ClN5O2S/c1-32(13-7-14-33-15-11-19-16-24(35-2)25(36-3)17-20(19)18-33)23-10-12-30-27(26(23)29)28-31-21-8-5-6-9-22(21)34(28)37-4/h5-6,8-10,12,16-17H,7,11,13-15,18H2,1-4H3