[2-[2-[3-ethyl-2-(2-methyl-5-nitro-phenyl)imino-4-oxidanylidene-1,3-thiazolidin-5-yl]ethanoylamino]phenyl] ethanoate

Systemtic Name: [2-[2-[3-ethyl-2-(2-methyl-5-nitro-phenyl)imino-4-oxidanylidene-1,3-thiazolidin-5-yl]ethanoylamino]phenyl] ethanoate Openeye Name: [2-[[2-[3-ethyl-2-(2-methyl-5-nitro-phenyl)imino-4-oxo-thiazolidin-5-yl]acetyl]amino]phenyl] acetate CAS Name: acetic acid [2-[[2-[3-ethyl-2-(2-methyl-5-nitrophenyl)imino-4-oxo-5-thiazolidinyl]-1-oxoethyl]amino]phenyl] ester IUPAC Name: [2-[[2-[3-ethyl-2-(2-methyl-5-nitrophenyl)imino-4-oxo-1,3-thiazolidin-5-yl]acetyl]amino]phenyl] acetate Traditional Name: acetic acid [2-[[2-[3-ethyl-4-keto-2-(2-methyl-5-nitro-phenyl)imino-thiazolidin-5-yl]acetyl]amino]phenyl] ester Formula: C22H22N4O6S MolecularWeight: 470.49828

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(SC1=NC2=C(C=CC(=C2)[N+](=O)[O-])C)CC(=O)NC3=CC=CC=C3OC(=O)C

Isomeric SMILES

CCN1C(=O)C(SC1=NC2=C(C=CC(=C2)[N+](=O)[O-])C)CC(=O)NC3=CC=CC=C3OC(=O)C

InChI

InChI=1S/C22H22N4O6S/c1-4-25-21(29)19(12-20(28)23-16-7-5-6-8-18(16)32-14(3)27)33-22(25)24-17-11-15(26(30)31)10-9-13(17)2/h5-11,19H,4,12H2,1-3H3,(H,23,28)