[2-oxidanylidene-2-[(3-sulfamoylphenyl)amino]ethyl] 3-phenothiazin-10-ylpropanoate

Systemtic Name: [2-oxidanylidene-2-[(3-sulfamoylphenyl)amino]ethyl] 3-phenothiazin-10-ylpropanoate Openeye Name: [2-oxo-2-(3-sulfamoylanilino)ethyl] 3-phenothiazin-10-ylpropanoate CAS Name: 3-(10-phenothiazinyl)propanoic acid [2-oxo-2-(3-sulfamoylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(3-sulfamoylanilino)ethyl] 3-phenothiazin-10-ylpropanoate Traditional Name: 3-phenothiazin-10-ylpropionic acid [2-keto-2-(3-sulfamoylanilino)ethyl] ester Formula: C23H21N3O5S2 MolecularWeight: 483.55994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)CCC(=O)OCC(=O)NC4=CC(=CC=C4)S(=O)(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)CCC(=O)OCC(=O)NC4=CC(=CC=C4)S(=O)(=O)N

InChI

InChI=1S/C23H21N3O5S2/c24-33(29,30)17-7-5-6-16(14-17)25-22(27)15-31-23(28)12-13-26-18-8-1-3-10-20(18)32-21-11-4-2-9-19(21)26/h1-11,14H,12-13,15H2,(H,25,27)(H2,24,29,30)