2-(1,3-benzoxazol-2-ylsulfanyl)-1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone CAS Name: 2-(1,3-benzoxazol-2-ylthio)-1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Formula: C26H24N2O4S MolecularWeight: 460.54476

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)CSC3=NC4=CC=CC=C4O3)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)CSC3=NC4=CC=CC=C4O3)C5=CC=CC=C5)OC

InChI

InChI=1S/C26H24N2O4S/c1-30-22-14-18-12-13-28(24(29)16-33-26-27-20-10-6-7-11-21(20)32-26)25(17-8-4-3-5-9-17)19(18)15-23(22)31-2/h3-11,14-15,25H,12-13,16H2,1-2H3