2-[3-[2-(5-bromanylthiophen-2-yl)ethyl-methyl-amino]propyl]-5,6-dimethoxy-3,4-dihydroisoquinolin-1-one

Systemtic Name: 2-[3-[2-(5-bromanylthiophen-2-yl)ethyl-methyl-amino]propyl]-5,6-dimethoxy-3,4-dihydroisoquinolin-1-one Openeye Name: 2-[3-[2-(5-bromo-2-thienyl)ethyl-methyl-amino]propyl]-5,6-dimethoxy-3,4-dihydroisoquinolin-1-one CAS Name: 2-[3-[2-(5-bromo-2-thiophenyl)ethyl-methylamino]propyl]-5,6-dimethoxy-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-[3-[2-(5-bromothiophen-2-yl)ethyl-methylamino]propyl]-5,6-dimethoxy-3,4-dihydroisoquinolin-1-one Traditional Name: 2-[3-[2-(5-bromo-2-thienyl)ethyl-methyl-amino]propyl]-5,6-dimethoxy-3,4-dihydroisocarbostyril Formula: C21H27BrN2O3S MolecularWeight: 467.41968

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCN1CCC2=C(C1=O)C=CC(=C2OC)OC)CCC3=CC=C(S3)Br

Isomeric SMILES

CN(CCCN1CCC2=C(C1=O)C=CC(=C2OC)OC)CCC3=CC=C(S3)Br

InChI

InChI=1S/C21H27BrN2O3S/c1-23(13-9-15-5-8-19(22)28-15)11-4-12-24-14-10-16-17(21(24)25)6-7-18(26-2)20(16)27-3/h5-8H,4,9-14H2,1-3H3