5,6-dimethoxy-2-[3-[2-(4-methoxy-1-benzothiophen-3-yl)ethyl-methyl-amino]propyl]-3H-isoindol-1-one

Systemtic Name: 5,6-dimethoxy-2-[3-[2-(4-methoxy-1-benzothiophen-3-yl)ethyl-methyl-amino]propyl]-3H-isoindol-1-one Openeye Name: 5,6-dimethoxy-2-[3-[2-(4-methoxybenzothiophen-3-yl)ethyl-methyl-amino]propyl]isoindolin-1-one CAS Name: 5,6-dimethoxy-2-[3-[2-(4-methoxy-1-benzothiophen-3-yl)ethyl-methylamino]propyl]-3H-isoindol-1-one IUPAC Name: 5,6-dimethoxy-2-[3-[2-(4-methoxy-1-benzothiophen-3-yl)ethyl-methylamino]propyl]-3H-isoindol-1-one Traditional Name: 5,6-dimethoxy-2-[3-[2-(4-methoxybenzothiophen-3-yl)ethyl-methyl-amino]propyl]isoindolin-1-one Formula: C25H30N2O4S MolecularWeight: 454.5817

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H30N2O4S/c1-26(12-9-17-16-32-23-8-5-7-20(29-2)24(17)23)10-6-11-27-15-18-13-21(30-3)22(31-4)14-19(18)25(27)28/h5,7-8,13-14,16H,6,9-12,15H2,1-4H3