[5-azanyl-1-(4-bromophenyl)sulfonyl-pyrazol-3-yl] 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate

Systemtic Name: [5-azanyl-1-(4-bromophenyl)sulfonyl-pyrazol-3-yl] 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate Openeye Name: [5-amino-1-(4-bromophenyl)sulfonyl-pyrazol-3-yl] 3-(2-chlorophenyl)-5-methyl-isoxazole-4-carboxylate CAS Name: 3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxylic acid [5-amino-1-(4-bromophenyl)sulfonyl-3-pyrazolyl] ester IUPAC Name: [5-amino-1-(4-bromophenyl)sulfonylpyrazol-3-yl] 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate Traditional Name: 3-(2-chlorophenyl)-5-methyl-isoxazole-4-carboxylic acid (5-amino-1-brosyl-pyrazol-3-yl) ester Formula: C20H14BrClN4O5S MolecularWeight: 537.77096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)OC3=NN(C(=C3)N)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)OC3=NN(C(=C3)N)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H14BrClN4O5S/c1-11-18(19(25-31-11)14-4-2-3-5-15(14)22)20(27)30-17-10-16(23)26(24-17)32(28,29)13-8-6-12(21)7-9-13/h2-10H,23H2,1H3