(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-[(3,5-dimethylphenyl)carbonylamino]ethanoate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-[(3,5-dimethylphenyl)carbonylamino]ethanoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 2-[(3,5-dimethylbenzoyl)amino]acetate CAS Name: 2-[[(3,5-dimethylphenyl)-oxomethyl]amino]acetic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 2-[(3,5-dimethylbenzoyl)amino]acetate Traditional Name: 2-[(3,5-dimethylbenzoyl)amino]acetic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C25H22N2O4S MolecularWeight: 446.51818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NCC(=O)OCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NCC(=O)OCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)C

InChI

InChI=1S/C25H22N2O4S/c1-16-11-17(2)13-18(12-16)25(30)26-14-24(29)31-15-23(28)27-19-7-3-5-9-21(19)32-22-10-6-4-8-20(22)27/h3-13H,14-15H2,1-2H3,(H,26,30)