ethyl 4-methyl-2-[3-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[3-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[3-(4-nitro-1,3-dioxo-isoindolin-2-yl)propanoylamino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[3-(4-nitro-1,3-dioxo-2-isoindolyl)-1-oxopropyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[3-(4-nitro-1,3-dioxoisoindol-2-yl)propanoylamino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[3-(1,3-diketo-4-nitro-isoindolin-2-yl)propanoylamino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C18H16N4O7S MolecularWeight: 432.40724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)CCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)CCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C18H16N4O7S/c1-3-29-17(26)14-9(2)19-18(30-14)20-12(23)7-8-21-15(24)10-5-4-6-11(22(27)28)13(10)16(21)25/h4-6H,3,7-8H2,1-2H3,(H,19,20,23)