[2-(2-methylsulfanylphenothiazin-10-yl)-2-oxidanylidene-ethyl] 5-methylfuran-2-carboxylate

Systemtic Name: [2-(2-methylsulfanylphenothiazin-10-yl)-2-oxidanylidene-ethyl] 5-methylfuran-2-carboxylate Openeye Name: [2-(2-methylsulfanylphenothiazin-10-yl)-2-oxo-ethyl] 5-methylfuran-2-carboxylate CAS Name: 5-methyl-2-furancarboxylic acid [2-[2-(methylthio)-10-phenothiazinyl]-2-oxoethyl] ester IUPAC Name: [2-(2-methylsulfanylphenothiazin-10-yl)-2-oxoethyl] 5-methylfuran-2-carboxylate Traditional Name: 5-methylfuran-2-carboxylic acid [2-keto-2-[2-(methylthio)phenothiazin-10-yl]ethyl] ester Formula: C21H17NO4S2 MolecularWeight: 411.49398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(=O)OCC(=O)N2C3=CC=CC=C3SC4=C2C=C(C=C4)SC

Isomeric SMILES

CC1=CC=C(O1)C(=O)OCC(=O)N2C3=CC=CC=C3SC4=C2C=C(C=C4)SC

InChI

InChI=1S/C21H17NO4S2/c1-13-7-9-17(26-13)21(24)25-12-20(23)22-15-5-3-4-6-18(15)28-19-10-8-14(27-2)11-16(19)22/h3-11H,12H2,1-2H3