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

Systemtic Name: methyl 2-[[(E)-1-nitroso-2-(oxidanylamino)-2-phenyl-ethenyl]amino]-5-propan-2-yl-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenyl-vinyl]amino]-5-isopropyl-thiazole-4-carboxylate CAS Name: 2-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenylethenyl]amino]-5-propan-2-yl-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenylethenyl]amino]-5-propan-2-yl-1,3-thiazole-4-carboxylate Traditional Name: 2-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenyl-vinyl]amino]-5-isopropyl-thiazole-4-carboxylic acid methyl ester Formula: C16H18N4O4S MolecularWeight: 362.40352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N=C(S1)NC(=C(C2=CC=CC=C2)NO)N=O)C(=O)OC

Isomeric SMILES

CC(C)C1=C(N=C(S1)N/C(=C(/C2=CC=CC=C2)\NO)/N=O)C(=O)OC

InChI

InChI=1S/C16H18N4O4S/c1-9(2)13-12(15(21)24-3)17-16(25-13)18-14(20-23)11(19-22)10-7-5-4-6-8-10/h4-9,19,22H,1-3H3,(H,17,18)/b14-11+