2-[4-(1,3-benzothiazol-2-yl)phenoxy]-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone

Systemtic Name: 2-[4-(1,3-benzothiazol-2-yl)phenoxy]-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Openeye Name: 2-[4-(1,3-benzothiazol-2-yl)phenoxy]-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone CAS Name: 2-[4-(1,3-benzothiazol-2-yl)phenoxy]-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone IUPAC Name: 2-[4-(1,3-benzothiazol-2-yl)phenoxy]-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Traditional Name: 2-[4-(1,3-benzothiazol-2-yl)phenoxy]-1-(6,7-dimethoxy-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=C2CN(CCC2=C1)C(=O)COC3=CC=C(C=C3)C4=NC5=CC=CC=C5S4)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)COC3=CC=C(C=C3)C4=NC5=CC=CC=C5S4)OC

InChI

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