6,7-dimethoxy-2-[3-[methyl(2-thiophen-2-ylethyl)amino]propyl]-3,4-dihydroisoquinolin-1-one

Systemtic Name: 6,7-dimethoxy-2-[3-[methyl(2-thiophen-2-ylethyl)amino]propyl]-3,4-dihydroisoquinolin-1-one Openeye Name: 6,7-dimethoxy-2-[3-[methyl-[2-(2-thienyl)ethyl]amino]propyl]-3,4-dihydroisoquinolin-1-one CAS Name: 6,7-dimethoxy-2-[3-[methyl(2-thiophen-2-ylethyl)amino]propyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 6,7-dimethoxy-2-[3-[methyl(2-thiophen-2-ylethyl)amino]propyl]-3,4-dihydroisoquinolin-1-one Traditional Name: 6,7-dimethoxy-2-[3-[methyl-[2-(2-thienyl)ethyl]amino]propyl]-3,4-dihydroisocarbostyril Formula: C21H28N2O3S MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCN1CCC2=CC(=C(C=C2C1=O)OC)OC)CCC3=CC=CS3

Isomeric SMILES

CN(CCCN1CCC2=CC(=C(C=C2C1=O)OC)OC)CCC3=CC=CS3

InChI

InChI=1S/C21H28N2O3S/c1-22(11-8-17-6-4-13-27-17)9-5-10-23-12-7-16-14-19(25-2)20(26-3)15-18(16)21(23)24/h4,6,13-15H,5,7-12H2,1-3H3