1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-4-(1H-indol-3-yl)butan-1-one

Systemtic Name: 1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-4-(1H-indol-3-yl)butan-1-one Openeye Name: 1-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-4-(1H-indol-3-yl)butan-1-one CAS Name: 1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-4-(1H-indol-3-yl)-1-butanone IUPAC Name: 1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-4-(1H-indol-3-yl)butan-1-one Traditional Name: 1-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-4-(1H-indol-3-yl)butan-1-one Formula: C27H28N2O3S MolecularWeight: 460.58782

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)CCCC3=CNC4=CC=CC=C43)C5=CC=CS5)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)CCCC3=CNC4=CC=CC=C43)C5=CC=CS5)OC

InChI

InChI=1S/C27H28N2O3S/c1-31-23-15-18-12-13-29(27(25-10-6-14-33-25)21(18)16-24(23)32-2)26(30)11-5-7-19-17-28-22-9-4-3-8-20(19)22/h3-4,6,8-10,14-17,27-28H,5,7,11-13H2,1-2H3