ethyl 4-[[2-cyano-2-[4-(6-nitro-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]ethenyl]amino]benzoate

Systemtic Name: ethyl 4-[[2-cyano-2-[4-(6-nitro-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]ethenyl]amino]benzoate Openeye Name: ethyl 4-[[2-cyano-2-[4-(6-nitro-2-oxo-chromen-3-yl)thiazol-2-yl]vinyl]amino]benzoate CAS Name: 4-[[2-cyano-2-[4-(6-nitro-2-oxo-1-benzopyran-3-yl)-2-thiazolyl]ethenyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-cyano-2-[4-(6-nitro-2-oxochromen-3-yl)-1,3-thiazol-2-yl]ethenyl]amino]benzoate Traditional Name: 4-[[2-cyano-2-[4-(2-keto-6-nitro-chromen-3-yl)thiazol-2-yl]vinyl]amino]benzoic acid ethyl ester Formula: C24H16N4O6S MolecularWeight: 488.47204

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC4=C(C=CC(=C4)[N+](=O)[O-])OC3=O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC4=C(C=CC(=C4)[N+](=O)[O-])OC3=O

InChI

InChI=1S/C24H16N4O6S/c1-2-33-23(29)14-3-5-17(6-4-14)26-12-16(11-25)22-27-20(13-35-22)19-10-15-9-18(28(31)32)7-8-21(15)34-24(19)30/h3-10,12-13,26H,2H2,1H3