N-(4-oxidanylidene-2-sulfanylidene-1H-benzo[g]pteridin-5-ium-8-yl)phenothiazine-10-carboxamide chloride

Systemtic Name: N-(4-oxidanylidene-2-sulfanylidene-1H-benzo[g]pteridin-5-ium-8-yl)phenothiazine-10-carboxamide chloride Openeye Name: N-(4-oxo-2-thioxo-1H-benzo[g]pteridin-5-ium-8-yl)phenothiazine-10-carboxamide chloride CAS Name: N-(4-oxo-2-sulfanylidene-1H-benzo[g]pteridin-5-ium-8-yl)-10-phenothiazinecarboxamide chloride IUPAC Name: N-(4-oxo-2-sulfanylidene-1H-benzo[g]pteridin-5-ium-8-yl)phenothiazine-10-carboxamide chloride Traditional Name: N-(4-keto-2-thioxo-1H-benzo[g]pteridin-5-ium-8-yl)phenothiazine-10-carboxamide chloride Formula: C23H15ClN6O2S2 MolecularWeight: 506.9872

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)C(=O)NC4=CC5=C(C=C4)[NH+]=C6C(=N5)NC(=S)NC6=O.[Cl-]

Isomeric SMILES

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)C(=O)NC4=CC5=C(C=C4)[NH+]=C6C(=N5)NC(=S)NC6=O.[Cl-]

InChI

InChI=1S/C23H14N6O2S2.ClH/c30-21-19-20(27-22(32)28-21)26-14-11-12(9-10-13(14)25-19)24-23(31)29-15-5-1-3-7-17(15)33-18-8-4-2-6-16(18)29;/h1-11H,(H,24,31)(H2,26,27,28,30,32);1H