(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 4-chloranyl-3-(diethylsulfamoyl)benzoate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 4-chloranyl-3-(diethylsulfamoyl)benzoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 4-chloro-3-(diethylsulfamoyl)benzoate CAS Name: 4-chloro-3-(diethylsulfamoyl)benzoic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 4-chloro-3-(diethylsulfamoyl)benzoate Traditional Name: 4-chloro-3-(diethylsulfamoyl)benzoic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C25H23ClN2O5S2 MolecularWeight: 531.04352

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)Cl

InChI

InChI=1S/C25H23ClN2O5S2/c1-3-27(4-2)35(31,32)23-15-17(13-14-18(23)26)25(30)33-16-24(29)28-19-9-5-7-11-21(19)34-22-12-8-6-10-20(22)28/h5-15H,3-4,16H2,1-2H3