(6-chloranylpyridazin-4-yl) 5-bromanyl-3-(2-cyclopropyl-6-methyl-phenoxy)thiophene-2-carboxylate

Systemtic Name: (6-chloranylpyridazin-4-yl) 5-bromanyl-3-(2-cyclopropyl-6-methyl-phenoxy)thiophene-2-carboxylate Openeye Name: (6-chloropyridazin-4-yl) 5-bromo-3-(2-cyclopropyl-6-methyl-phenoxy)thiophene-2-carboxylate CAS Name: 5-bromo-3-(2-cyclopropyl-6-methylphenoxy)-2-thiophenecarboxylic acid (6-chloro-4-pyridazinyl) ester IUPAC Name: (6-chloropyridazin-4-yl) 5-bromo-3-(2-cyclopropyl-6-methylphenoxy)thiophene-2-carboxylate Traditional Name: 5-bromo-3-(2-cyclopropyl-6-methyl-phenoxy)thiophene-2-carboxylic acid (6-chloropyridazin-4-yl) ester Formula: C19H14BrClN2O3S MolecularWeight: 465.74806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1OC2=C(SC(=C2)Br)C(=O)OC3=CC(=NN=C3)Cl)C4CC4

Isomeric SMILES

CC1=CC=CC(=C1OC2=C(SC(=C2)Br)C(=O)OC3=CC(=NN=C3)Cl)C4CC4

InChI

InChI=1S/C19H14BrClN2O3S/c1-10-3-2-4-13(11-5-6-11)17(10)26-14-8-15(20)27-18(14)19(24)25-12-7-16(21)23-22-9-12/h2-4,7-9,11H,5-6H2,1H3