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

Systemtic Name: methyl 2-[[(E)-1-nitroso-2-(oxidanylamino)-2-phenyl-ethenyl]amino]-5-phenyl-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenyl-vinyl]amino]-5-phenyl-thiazole-4-carboxylate CAS Name: 2-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenylethenyl]amino]-5-phenyl-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenylethenyl]amino]-5-phenyl-1,3-thiazole-4-carboxylate Traditional Name: 2-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenyl-vinyl]amino]-5-phenyl-thiazole-4-carboxylic acid methyl ester Formula: C19H16N4O4S MolecularWeight: 396.41974

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=N1)NC(=C(C2=CC=CC=C2)NO)N=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(SC(=N1)N/C(=C(/C2=CC=CC=C2)\NO)/N=O)C3=CC=CC=C3

InChI

InChI=1S/C19H16N4O4S/c1-27-18(24)15-16(13-10-6-3-7-11-13)28-19(20-15)21-17(23-26)14(22-25)12-8-4-2-5-9-12/h2-11,22,25H,1H3,(H,20,21)/b17-14+