(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-pyridin-3-yl-3H-benzimidazole-5-carboxylate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-pyridin-3-yl-3H-benzimidazole-5-carboxylate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 2-(3-pyridyl)-3H-benzimidazole-5-carboxylate CAS Name: 2-(3-pyridinyl)-3H-benzimidazole-5-carboxylic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 2-pyridin-3-yl-3H-benzimidazole-5-carboxylate Traditional Name: 2-(3-pyridyl)-3H-benzimidazole-5-carboxylic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C27H18N4O3S MolecularWeight: 478.52182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)C(=O)COC(=O)C4=CC5=C(C=C4)N=C(N5)C6=CN=CC=C6

Isomeric SMILES

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)C(=O)COC(=O)C4=CC5=C(C=C4)N=C(N5)C6=CN=CC=C6

InChI

InChI=1S/C27H18N4O3S/c32-25(31-21-7-1-3-9-23(21)35-24-10-4-2-8-22(24)31)16-34-27(33)17-11-12-19-20(14-17)30-26(29-19)18-6-5-13-28-15-18/h1-15H,16H2,(H,29,30)