5-[4-(bromomethyl)-2-phenyl-1,3-thiazol-5-yl]-1H-pyrazole-3-carboxylic acid

Systemtic Name: 5-[4-(bromomethyl)-2-phenyl-1,3-thiazol-5-yl]-1H-pyrazole-3-carboxylic acid Openeye Name: 5-[4-(bromomethyl)-2-phenyl-thiazol-5-yl]-1H-pyrazole-3-carboxylic acid CAS Name: 5-[4-(bromomethyl)-2-phenyl-5-thiazolyl]-1H-pyrazole-3-carboxylic acid IUPAC Name: 5-[4-(bromomethyl)-2-phenyl-1,3-thiazol-5-yl]-1H-pyrazole-3-carboxylic acid Traditional Name: 5-[4-(bromomethyl)-2-phenyl-thiazol-5-yl]-1H-pyrazole-3-carboxylic acid Formula: C14H10BrN3O2S MolecularWeight: 364.2171

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=C(S2)C3=CC(=NN3)C(=O)O)CBr

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C(S2)C3=CC(=NN3)C(=O)O)CBr

InChI

InChI=1S/C14H10BrN3O2S/c15-7-11-12(9-6-10(14(19)20)18-17-9)21-13(16-11)8-4-2-1-3-5-8/h1-6H,7H2,(H,17,18)(H,19,20)