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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC1=CSC=C1)CCCN2CCC3=C(C2=O)C=CC(=C3OC)OC

Isomeric SMILES

CN(CCCC1=CSC=C1)CCCN2CCC3=C(C2=O)C=CC(=C3OC)OC

InChI

InChI=1S/C22H30N2O3S/c1-23(11-4-6-17-10-15-28-16-17)12-5-13-24-14-9-18-19(22(24)25)7-8-20(26-2)21(18)27-3/h7-8,10,15-16H,4-6,9,11-14H2,1-3H3