(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 4-methyl-3-[(3-methylphenyl)sulfamoyl]benzoate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 4-methyl-3-[(3-methylphenyl)sulfamoyl]benzoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 4-methyl-3-(m-tolylsulfamoyl)benzoate CAS Name: 4-methyl-3-[(3-methylphenyl)sulfamoyl]benzoic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 4-methyl-3-[(3-methylphenyl)sulfamoyl]benzoate Traditional Name: 4-methyl-3-(m-tolylsulfamoyl)benzoic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C29H24N2O5S2 MolecularWeight: 544.64126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)C

Isomeric SMILES

CC1=CC(=CC=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)C

InChI

InChI=1S/C29H24N2O5S2/c1-19-8-7-9-22(16-19)30-38(34,35)27-17-21(15-14-20(27)2)29(33)36-18-28(32)31-23-10-3-5-12-25(23)37-26-13-6-4-11-24(26)31/h3-17,30H,18H2,1-2H3