1-(4-bromophenyl)-5-[2-(2,2-dimethylpropanoylamino)-4-methyl-1,3-thiazol-5-yl]pyrazole-3-carboxylic acid

Systemtic Name: 1-(4-bromophenyl)-5-[2-(2,2-dimethylpropanoylamino)-4-methyl-1,3-thiazol-5-yl]pyrazole-3-carboxylic acid Openeye Name: 1-(4-bromophenyl)-5-[2-(2,2-dimethylpropanoylamino)-4-methyl-thiazol-5-yl]pyrazole-3-carboxylic acid CAS Name: 1-(4-bromophenyl)-5-[2-[(2,2-dimethyl-1-oxopropyl)amino]-4-methyl-5-thiazolyl]-3-pyrazolecarboxylic acid IUPAC Name: 1-(4-bromophenyl)-5-[2-(2,2-dimethylpropanoylamino)-4-methyl-1,3-thiazol-5-yl]pyrazole-3-carboxylic acid Traditional Name: 1-(4-bromophenyl)-5-[4-methyl-2-(pivaloylamino)thiazol-5-yl]pyrazole-3-carboxylic acid Formula: C19H19BrN4O3S MolecularWeight: 463.34816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C(C)(C)C)C2=CC(=NN2C3=CC=C(C=C3)Br)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C(C)(C)C)C2=CC(=NN2C3=CC=C(C=C3)Br)C(=O)O

InChI

InChI=1S/C19H19BrN4O3S/c1-10-15(28-18(21-10)22-17(27)19(2,3)4)14-9-13(16(25)26)23-24(14)12-7-5-11(20)6-8-12/h5-9H,1-4H3,(H,25,26)(H,21,22,27)