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

Systemtic Name: 1-methyl-5-[[5-methyl-1-[(3-methylphenyl)methyl]pyrazol-3-yl]carbamoyl]pyrazole-4-carboxylic acid Openeye Name: 1-methyl-5-[[5-methyl-1-(m-tolylmethyl)pyrazol-3-yl]carbamoyl]pyrazole-4-carboxylic acid CAS Name: 1-methyl-5-[[[5-methyl-1-[(3-methylphenyl)methyl]-3-pyrazolyl]amino]-oxomethyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-methyl-5-[[5-methyl-1-[(3-methylphenyl)methyl]pyrazol-3-yl]carbamoyl]pyrazole-4-carboxylic acid Traditional Name: 1-methyl-5-[[5-methyl-1-(3-methylbenzyl)pyrazol-3-yl]carbamoyl]pyrazole-4-carboxylic acid Formula: C18H19N5O3 MolecularWeight: 353.37516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C(=CC(=N2)NC(=O)C3=C(C=NN3C)C(=O)O)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2C(=CC(=N2)NC(=O)C3=C(C=NN3C)C(=O)O)C

InChI

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