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

Systemtic Name: 2-[3-[2-(1-benzothiophen-2-yl)ethyl-methyl-amino]propyl]-5,6-dimethoxy-3,4-dihydroisoquinolin-1-one Openeye Name: 2-[3-[2-(benzothiophen-2-yl)ethyl-methyl-amino]propyl]-5,6-dimethoxy-3,4-dihydroisoquinolin-1-one CAS Name: 2-[3-[2-(1-benzothiophen-2-yl)ethyl-methylamino]propyl]-5,6-dimethoxy-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-[3-[2-(1-benzothiophen-2-yl)ethyl-methylamino]propyl]-5,6-dimethoxy-3,4-dihydroisoquinolin-1-one Traditional Name: 2-[3-[2-(benzothiophen-2-yl)ethyl-methyl-amino]propyl]-5,6-dimethoxy-3,4-dihydroisocarbostyril Formula: C25H30N2O3S MolecularWeight: 438.5823

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCN1CCC2=C(C1=O)C=CC(=C2OC)OC)CCC3=CC4=CC=CC=C4S3

Isomeric SMILES

CN(CCCN1CCC2=C(C1=O)C=CC(=C2OC)OC)CCC3=CC4=CC=CC=C4S3

InChI

InChI=1S/C25H30N2O3S/c1-26(15-11-19-17-18-7-4-5-8-23(18)31-19)13-6-14-27-16-12-20-21(25(27)28)9-10-22(29-2)24(20)30-3/h4-5,7-10,17H,6,11-16H2,1-3H3