(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-thiophen-2-ylquinoline-4-carboxylate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-thiophen-2-ylquinoline-4-carboxylate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 2-(2-thienyl)quinoline-4-carboxylate CAS Name: 2-thiophen-2-yl-4-quinolinecarboxylic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 2-thiophen-2-ylquinoline-4-carboxylate Traditional Name: 2-(2-thienyl)cinchoninic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C28H18N2O3S2 MolecularWeight: 494.58412

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)OCC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)OCC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64

InChI

InChI=1S/C28H18N2O3S2/c31-27(30-22-10-3-5-12-25(22)35-26-13-6-4-11-23(26)30)17-33-28(32)19-16-21(24-14-7-15-34-24)29-20-9-2-1-8-18(19)20/h1-16H,17H2