5-[[4-bromanyl-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]carbamoyl]-1-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-[[4-bromanyl-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]carbamoyl]-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 5-[[4-bromo-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]carbamoyl]-1-methyl-pyrazole-4-carboxylic acid CAS Name: 5-[[[4-bromo-1-[(3,4-dichlorophenyl)methyl]-3-pyrazolyl]amino]-oxomethyl]-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 5-[[4-bromo-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]carbamoyl]-1-methylpyrazole-4-carboxylic acid Traditional Name: 5-[[4-bromo-1-(3,4-dichlorobenzyl)pyrazol-3-yl]carbamoyl]-1-methyl-pyrazole-4-carboxylic acid Formula: C16H12BrCl2N5O3 MolecularWeight: 473.10818

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)O)C(=O)NC2=NN(C=C2Br)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CN1C(=C(C=N1)C(=O)O)C(=O)NC2=NN(C=C2Br)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C16H12BrCl2N5O3/c1-23-13(9(5-20-23)16(26)27)15(25)21-14-10(17)7-24(22-14)6-8-2-3-11(18)12(19)4-8/h2-5,7H,6H2,1H3,(H,26,27)(H,21,22,25)