methyl 5-ethyl-2-[[(E)-1-nitroso-2-(oxidanylamino)-2-phenyl-ethenyl]amino]-1,3-thiazole-4-carboxylate

Systemtic Name: methyl 5-ethyl-2-[[(E)-1-nitroso-2-(oxidanylamino)-2-phenyl-ethenyl]amino]-1,3-thiazole-4-carboxylate Openeye Name: methyl 5-ethyl-2-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenyl-vinyl]amino]thiazole-4-carboxylate CAS Name: 5-ethyl-2-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenylethenyl]amino]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 5-ethyl-2-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenylethenyl]amino]-1,3-thiazole-4-carboxylate Traditional Name: 5-ethyl-2-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenyl-vinyl]amino]thiazole-4-carboxylic acid methyl ester Formula: C15H16N4O4S MolecularWeight: 348.37694

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(S1)NC(=C(C2=CC=CC=C2)NO)N=O)C(=O)OC

Isomeric SMILES

CCC1=C(N=C(S1)N/C(=C(/C2=CC=CC=C2)\NO)/N=O)C(=O)OC

InChI

InChI=1S/C15H16N4O4S/c1-3-10-12(14(20)23-2)16-15(24-10)17-13(19-22)11(18-21)9-7-5-4-6-8-9/h4-8,18,21H,3H2,1-2H3,(H,16,17)/b13-11+