2-[3-[2-(1-benzothiophen-3-yl)ethyl-methyl-amino]propyl]-5,6-dimethoxy-3H-isoindol-1-one dihydrochloride

Systemtic Name: 2-[3-[2-(1-benzothiophen-3-yl)ethyl-methyl-amino]propyl]-5,6-dimethoxy-3H-isoindol-1-one dihydrochloride Openeye Name: 2-[3-[2-(benzothiophen-3-yl)ethyl-methyl-amino]propyl]-5,6-dimethoxy-isoindolin-1-one dihydrochloride CAS Name: 2-[3-[2-(1-benzothiophen-3-yl)ethyl-methylamino]propyl]-5,6-dimethoxy-3H-isoindol-1-one dihydrochloride IUPAC Name: 2-[3-[2-(1-benzothiophen-3-yl)ethyl-methylamino]propyl]-5,6-dimethoxy-3H-isoindol-1-one dihydrochloride Traditional Name: 2-[3-[2-(benzothiophen-3-yl)ethyl-methyl-amino]propyl]-5,6-dimethoxy-isoindolin-1-one dihydrochloride Formula: C24H30Cl2N2O3S MolecularWeight: 497.4776

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCN1CC2=CC(=C(C=C2C1=O)OC)OC)CCC3=CSC4=CC=CC=C43.Cl.Cl

Isomeric SMILES

CN(CCCN1CC2=CC(=C(C=C2C1=O)OC)OC)CCC3=CSC4=CC=CC=C43.Cl.Cl

InChI

InChI=1S/C24H28N2O3S.2ClH/c1-25(12-9-17-16-30-23-8-5-4-7-19(17)23)10-6-11-26-15-18-13-21(28-2)22(29-3)14-20(18)24(26)27;;/h4-5,7-8,13-14,16H,6,9-12,15H2,1-3H3;2*1H