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

Systemtic Name: 5,6-dimethoxy-3-[3-[methyl(5-thiophen-3-ylpentyl)amino]propyl]isoindol-1-one Openeye Name: 5,6-dimethoxy-3-[3-[methyl-[5-(3-thienyl)pentyl]amino]propyl]isoindol-1-one CAS Name: 5,6-dimethoxy-3-[3-[methyl-[5-(3-thiophenyl)pentyl]amino]propyl]-1-isoindolone IUPAC Name: 5,6-dimethoxy-3-[3-[methyl(5-thiophen-3-ylpentyl)amino]propyl]isoindol-1-one Traditional Name: 5,6-dimethoxy-3-[3-[methyl-[5-(3-thienyl)pentyl]amino]propyl]isoindol-1-one Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCCC1=CSC=C1)CCCC2=NC(=O)C3=CC(=C(C=C32)OC)OC

Isomeric SMILES

CN(CCCCCC1=CSC=C1)CCCC2=NC(=O)C3=CC(=C(C=C32)OC)OC

InChI

InChI=1S/C23H30N2O3S/c1-25(11-6-4-5-8-17-10-13-29-16-17)12-7-9-20-18-14-21(27-2)22(28-3)15-19(18)23(26)24-20/h10,13-16H,4-9,11-12H2,1-3H3