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

Systemtic Name: 5,6-dimethyl-2-[3-[methyl(5-thiophen-3-ylpentyl)amino]propyl]-3H-isoindol-1-one Openeye Name: 5,6-dimethyl-2-[3-[methyl-[5-(3-thienyl)pentyl]amino]propyl]isoindolin-1-one CAS Name: 5,6-dimethyl-2-[3-[methyl-[5-(3-thiophenyl)pentyl]amino]propyl]-3H-isoindol-1-one IUPAC Name: 5,6-dimethyl-2-[3-[methyl(5-thiophen-3-ylpentyl)amino]propyl]-3H-isoindol-1-one Traditional Name: 5,6-dimethyl-2-[3-[methyl-[5-(3-thienyl)pentyl]amino]propyl]isoindolin-1-one Formula: C23H32N2OS MolecularWeight: 384.57798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)CN(C2=O)CCCN(C)CCCCCC3=CSC=C3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)CN(C2=O)CCCN(C)CCCCCC3=CSC=C3)C

InChI

InChI=1S/C23H32N2OS/c1-18-14-21-16-25(23(26)22(21)15-19(18)2)12-7-11-24(3)10-6-4-5-8-20-9-13-27-17-20/h9,13-15,17H,4-8,10-12,16H2,1-3H3