[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl] 3-phenothiazin-10-ylpropanoate

Systemtic Name: [2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl] 3-phenothiazin-10-ylpropanoate Openeye Name: [2-oxo-2-(2,4,6-trimethylanilino)ethyl] 3-phenothiazin-10-ylpropanoate CAS Name: 3-(10-phenothiazinyl)propanoic acid [2-oxo-2-(2,4,6-trimethylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,6-trimethylanilino)ethyl] 3-phenothiazin-10-ylpropanoate Traditional Name: 3-phenothiazin-10-ylpropionic acid (2-keto-2-mesidino-ethyl) ester Formula: C26H26N2O3S MolecularWeight: 446.56124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)COC(=O)CCN2C3=CC=CC=C3SC4=CC=CC=C42)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)COC(=O)CCN2C3=CC=CC=C3SC4=CC=CC=C42)C

InChI

InChI=1S/C26H26N2O3S/c1-17-14-18(2)26(19(3)15-17)27-24(29)16-31-25(30)12-13-28-20-8-4-6-10-22(20)32-23-11-7-5-9-21(23)28/h4-11,14-15H,12-13,16H2,1-3H3,(H,27,29)