(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-(2,4-dimethylquinolin-3-yl)ethanoate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-(2,4-dimethylquinolin-3-yl)ethanoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 2-(2,4-dimethyl-3-quinolyl)acetate CAS Name: 2-(2,4-dimethyl-3-quinolinyl)acetic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 2-(2,4-dimethylquinolin-3-yl)acetate Traditional Name: 2-(2,4-dimethyl-3-quinolyl)acetic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C27H22N2O3S MolecularWeight: 454.54018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)C)CC(=O)OCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)C)CC(=O)OCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

InChI

InChI=1S/C27H22N2O3S/c1-17-19-9-3-4-10-21(19)28-18(2)20(17)15-27(31)32-16-26(30)29-22-11-5-7-13-24(22)33-25-14-8-6-12-23(25)29/h3-14H,15-16H2,1-2H3