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

Systemtic Name: 2-[3-[2-(5-bromanylthiophen-2-yl)ethyl-methyl-amino]propyl]-5,6-dimethyl-3,4-dihydroisoquinolin-1-one Openeye Name: 2-[3-[2-(5-bromo-2-thienyl)ethyl-methyl-amino]propyl]-5,6-dimethyl-3,4-dihydroisoquinolin-1-one CAS Name: 2-[3-[2-(5-bromo-2-thiophenyl)ethyl-methylamino]propyl]-5,6-dimethyl-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-[3-[2-(5-bromothiophen-2-yl)ethyl-methylamino]propyl]-5,6-dimethyl-3,4-dihydroisoquinolin-1-one Traditional Name: 2-[3-[2-(5-bromo-2-thienyl)ethyl-methyl-amino]propyl]-5,6-dimethyl-3,4-dihydroisocarbostyril Formula: C21H27BrN2OS MolecularWeight: 435.42088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=O)N(CC2)CCCN(C)CCC3=CC=C(S3)Br)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=O)N(CC2)CCCN(C)CCC3=CC=C(S3)Br)C

InChI

InChI=1S/C21H27BrN2OS/c1-15-5-7-19-18(16(15)2)10-14-24(21(19)25)12-4-11-23(3)13-9-17-6-8-20(22)26-17/h5-8H,4,9-14H2,1-3H3