ethyl 5-bromanyl-2-[(2E)-2-(phenylmethylidene)hydrazinyl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 5-bromanyl-2-[(2E)-2-(phenylmethylidene)hydrazinyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[(2E)-2-benzylidenehydrazino]-5-bromo-thiazole-4-carboxylate CAS Name: 5-bromo-2-[(2E)-2-(phenylmethylene)hydrazinyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2E)-2-benzylidenehydrazinyl]-5-bromo-1,3-thiazole-4-carboxylate Traditional Name: 2-[(N'E)-N'-benzalhydrazino]-5-bromo-thiazole-4-carboxylic acid ethyl ester Formula: C13H12BrN3O2S MolecularWeight: 354.22228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=N1)NN=CC2=CC=CC=C2)Br

Isomeric SMILES

CCOC(=O)C1=C(SC(=N1)N/N=C/C2=CC=CC=C2)Br

InChI

InChI=1S/C13H12BrN3O2S/c1-2-19-12(18)10-11(14)20-13(16-10)17-15-8-9-6-4-3-5-7-9/h3-8H,2H2,1H3,(H,16,17)/b15-8+