1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-morpholin-4-ylsulfonylphenyl)propan-1-one

Systemtic Name: 1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-morpholin-4-ylsulfonylphenyl)propan-1-one Openeye Name: 1-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-(4-morpholinosulfonylphenyl)propan-1-one CAS Name: 1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(4-morpholinylsulfonyl)phenyl]-1-propanone IUPAC Name: 1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-morpholin-4-ylsulfonylphenyl)propan-1-one Traditional Name: 1-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-(4-morpholinosulfonylphenyl)propan-1-one Formula: C28H32N2O6S2 MolecularWeight: 556.69348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)C5=CC=CS5)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)C5=CC=CS5)OC

InChI

InChI=1S/C28H32N2O6S2/c1-34-24-18-21-11-12-30(28(26-4-3-17-37-26)23(21)19-25(24)35-2)27(31)10-7-20-5-8-22(9-6-20)38(32,33)29-13-15-36-16-14-29/h3-6,8-9,17-19,28H,7,10-16H2,1-2H3