5,6-dimethyl-2-[3-[methyl(4-thiophen-3-ylbutyl)amino]propyl]-3H-isoindol-1-one

Systemtic Name: 5,6-dimethyl-2-[3-[methyl(4-thiophen-3-ylbutyl)amino]propyl]-3H-isoindol-1-one Openeye Name: 5,6-dimethyl-2-[3-[methyl-[4-(3-thienyl)butyl]amino]propyl]isoindolin-1-one CAS Name: 5,6-dimethyl-2-[3-[methyl-[4-(3-thiophenyl)butyl]amino]propyl]-3H-isoindol-1-one IUPAC Name: 5,6-dimethyl-2-[3-[methyl(4-thiophen-3-ylbutyl)amino]propyl]-3H-isoindol-1-one Traditional Name: 5,6-dimethyl-2-[3-[methyl-[4-(3-thienyl)butyl]amino]propyl]isoindolin-1-one Formula: C22H30N2OS MolecularWeight: 370.5514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)CN(C2=O)CCCN(C)CCCCC3=CSC=C3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)CN(C2=O)CCCN(C)CCCCC3=CSC=C3)C

InChI

InChI=1S/C22H30N2OS/c1-17-13-20-15-24(22(25)21(20)14-18(17)2)11-6-10-23(3)9-5-4-7-19-8-12-26-16-19/h8,12-14,16H,4-7,9-11,15H2,1-3H3