(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-[(4-bromophenyl)carbonylamino]ethanoate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-[(4-bromophenyl)carbonylamino]ethanoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 2-[(4-bromobenzoyl)amino]acetate CAS Name: 2-[[(4-bromophenyl)-oxomethyl]amino]acetic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 2-[(4-bromobenzoyl)amino]acetate Traditional Name: 2-[(4-bromobenzoyl)amino]acetic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C23H17BrN2O4S MolecularWeight: 497.36108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)C(=O)COC(=O)CNC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)C(=O)COC(=O)CNC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H17BrN2O4S/c24-16-11-9-15(10-12-16)23(29)25-13-22(28)30-14-21(27)26-17-5-1-3-7-19(17)31-20-8-4-2-6-18(20)26/h1-12H,13-14H2,(H,25,29)