2-[3-[2-(5-bromanylthiophen-2-yl)ethyl-methyl-amino]propyl]-5,6-dimethyl-3H-isoindol-1-one

Systemtic Name: 2-[3-[2-(5-bromanylthiophen-2-yl)ethyl-methyl-amino]propyl]-5,6-dimethyl-3H-isoindol-1-one Openeye Name: 2-[3-[2-(5-bromo-2-thienyl)ethyl-methyl-amino]propyl]-5,6-dimethyl-isoindolin-1-one CAS Name: 2-[3-[2-(5-bromo-2-thiophenyl)ethyl-methylamino]propyl]-5,6-dimethyl-3H-isoindol-1-one IUPAC Name: 2-[3-[2-(5-bromothiophen-2-yl)ethyl-methylamino]propyl]-5,6-dimethyl-3H-isoindol-1-one Traditional Name: 2-[3-[2-(5-bromo-2-thienyl)ethyl-methyl-amino]propyl]-5,6-dimethyl-isoindolin-1-one Formula: C20H25BrN2OS MolecularWeight: 421.3943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)CN(C2=O)CCCN(C)CCC3=CC=C(S3)Br)C

Isomeric SMILES

CC1=C(C=C2C(=C1)CN(C2=O)CCCN(C)CCC3=CC=C(S3)Br)C

InChI

InChI=1S/C20H25BrN2OS/c1-14-11-16-13-23(20(24)18(16)12-15(14)2)9-4-8-22(3)10-7-17-5-6-19(21)25-17/h5-6,11-12H,4,7-10,13H2,1-3H3