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

Systemtic Name: 5,6-dimethyl-2-[3-[methyl(3-thiophen-2-ylpropyl)amino]propyl]-3H-isoindol-1-one Openeye Name: 5,6-dimethyl-2-[3-[methyl-[3-(2-thienyl)propyl]amino]propyl]isoindolin-1-one CAS Name: 5,6-dimethyl-2-[3-[methyl(3-thiophen-2-ylpropyl)amino]propyl]-3H-isoindol-1-one IUPAC Name: 5,6-dimethyl-2-[3-[methyl(3-thiophen-2-ylpropyl)amino]propyl]-3H-isoindol-1-one Traditional Name: 5,6-dimethyl-2-[3-[methyl-[3-(2-thienyl)propyl]amino]propyl]isoindolin-1-one Formula: C21H28N2OS MolecularWeight: 356.52482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)CN(C2=O)CCCN(C)CCCC3=CC=CS3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)CN(C2=O)CCCN(C)CCCC3=CC=CS3)C

InChI

InChI=1S/C21H28N2OS/c1-16-13-18-15-23(21(24)20(18)14-17(16)2)11-6-10-22(3)9-4-7-19-8-5-12-25-19/h5,8,12-14H,4,6-7,9-11,15H2,1-3H3