[1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethanoate

Systemtic Name: [1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethanoate Openeye Name: [1-methyl-2-(2-nitroanilino)-2-oxo-ethyl] 2-[2-(2-pyridyl)thiazol-4-yl]acetate CAS Name: 2-[2-(2-pyridinyl)-4-thiazolyl]acetic acid [1-(2-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-nitroanilino)-1-oxopropan-2-yl] 2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetate Traditional Name: 2-[2-(2-pyridyl)thiazol-4-yl]acetic acid [2-keto-1-methyl-2-(2-nitroanilino)ethyl] ester Formula: C19H16N4O5S MolecularWeight: 412.41914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1[N+](=O)[O-])OC(=O)CC2=CSC(=N2)C3=CC=CC=N3

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1[N+](=O)[O-])OC(=O)CC2=CSC(=N2)C3=CC=CC=N3

InChI

InChI=1S/C19H16N4O5S/c1-12(18(25)22-14-6-2-3-8-16(14)23(26)27)28-17(24)10-13-11-29-19(21-13)15-7-4-5-9-20-15/h2-9,11-12H,10H2,1H3,(H,22,25)