2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-phenothiazin-10-yl-ethanone

Systemtic Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-phenothiazin-10-yl-ethanone Openeye Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-phenothiazin-10-yl-ethanone CAS Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(10-phenothiazinyl)ethanone IUPAC Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-phenothiazin-10-ylethanone Traditional Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-phenothiazin-10-yl-ethanone Formula: C25H24N2O3S MolecularWeight: 432.53466

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)CC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)CC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)OC

InChI

InChI=1S/C25H24N2O3S/c1-29-21-13-17-11-12-26(15-18(17)14-22(21)30-2)16-25(28)27-19-7-3-5-9-23(19)31-24-10-6-4-8-20(24)27/h3-10,13-14H,11-12,15-16H2,1-2H3