(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-(1H-benzimidazol-2-yl)benzoate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-(1H-benzimidazol-2-yl)benzoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 2-(1H-benzimidazol-2-yl)benzoate CAS Name: 2-(1H-benzimidazol-2-yl)benzoic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 2-(1H-benzimidazol-2-yl)benzoate Traditional Name: 2-(1H-benzimidazol-2-yl)benzoic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C28H19N3O3S MolecularWeight: 477.53376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3N2)C(=O)OCC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3N2)C(=O)OCC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64

InChI

InChI=1S/C28H19N3O3S/c32-26(31-22-13-5-7-15-24(22)35-25-16-8-6-14-23(25)31)17-34-28(33)19-10-2-1-9-18(19)27-29-20-11-3-4-12-21(20)30-27/h1-16H,17H2,(H,29,30)