5,6-dimethoxy-2-[3-[methyl(3-thiophen-2-ylpropyl)amino]propyl]-3,4-dihydroisoquinolin-1-one

Systemtic Name: 5,6-dimethoxy-2-[3-[methyl(3-thiophen-2-ylpropyl)amino]propyl]-3,4-dihydroisoquinolin-1-one Openeye Name: 5,6-dimethoxy-2-[3-[methyl-[3-(2-thienyl)propyl]amino]propyl]-3,4-dihydroisoquinolin-1-one CAS Name: 5,6-dimethoxy-2-[3-[methyl(3-thiophen-2-ylpropyl)amino]propyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 5,6-dimethoxy-2-[3-[methyl(3-thiophen-2-ylpropyl)amino]propyl]-3,4-dihydroisoquinolin-1-one Traditional Name: 5,6-dimethoxy-2-[3-[methyl-[3-(2-thienyl)propyl]amino]propyl]-3,4-dihydroisocarbostyril Formula: C22H30N2O3S MolecularWeight: 402.5502

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC1=CC=CS1)CCCN2CCC3=C(C2=O)C=CC(=C3OC)OC

Isomeric SMILES

CN(CCCC1=CC=CS1)CCCN2CCC3=C(C2=O)C=CC(=C3OC)OC

InChI

InChI=1S/C22H30N2O3S/c1-23(12-4-7-17-8-5-16-28-17)13-6-14-24-15-11-18-19(22(24)25)9-10-20(26-2)21(18)27-3/h5,8-10,16H,4,6-7,11-15H2,1-3H3