5,6-dimethoxy-2-[3-[methyl(5-thiophen-2-ylpentyl)amino]propyl]-3H-isoindol-1-one

Systemtic Name: 5,6-dimethoxy-2-[3-[methyl(5-thiophen-2-ylpentyl)amino]propyl]-3H-isoindol-1-one Openeye Name: 5,6-dimethoxy-2-[3-[methyl-[5-(2-thienyl)pentyl]amino]propyl]isoindolin-1-one CAS Name: 5,6-dimethoxy-2-[3-[methyl(5-thiophen-2-ylpentyl)amino]propyl]-3H-isoindol-1-one IUPAC Name: 5,6-dimethoxy-2-[3-[methyl(5-thiophen-2-ylpentyl)amino]propyl]-3H-isoindol-1-one Traditional Name: 5,6-dimethoxy-2-[3-[methyl-[5-(2-thienyl)pentyl]amino]propyl]isoindolin-1-one Formula: C23H32N2O3S MolecularWeight: 416.57678

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCCC1=CC=CS1)CCCN2CC3=CC(=C(C=C3C2=O)OC)OC

Isomeric SMILES

CN(CCCCCC1=CC=CS1)CCCN2CC3=CC(=C(C=C3C2=O)OC)OC

InChI

InChI=1S/C23H32N2O3S/c1-24(11-6-4-5-9-19-10-7-14-29-19)12-8-13-25-17-18-15-21(27-2)22(28-3)16-20(18)23(25)26/h7,10,14-16H,4-6,8-9,11-13,17H2,1-3H3