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

Systemtic Name: 5-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]carbamoyl]-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 5-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)carbamoyl]-1-methyl-pyrazole-4-carboxylic acid CAS Name: 5-[[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]amino]-oxomethyl]-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 5-[(1-benzyl-3,5-dimethylpyrazol-4-yl)carbamoyl]-1-methylpyrazole-4-carboxylic acid Traditional Name: 5-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)carbamoyl]-1-methyl-pyrazole-4-carboxylic acid Formula: C18H19N5O3 MolecularWeight: 353.37516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)NC(=O)C3=C(C=NN3C)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)NC(=O)C3=C(C=NN3C)C(=O)O

InChI

InChI=1S/C18H19N5O3/c1-11-15(12(2)23(21-11)10-13-7-5-4-6-8-13)20-17(24)16-14(18(25)26)9-19-22(16)3/h4-9H,10H2,1-3H3,(H,20,24)(H,25,26)