1-[3-[[5-methyl-1-[(2-methylphenyl)methyl]pyrazol-3-yl]amino]-3-oxidanylidene-propyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-[3-[[5-methyl-1-[(2-methylphenyl)methyl]pyrazol-3-yl]amino]-3-oxidanylidene-propyl]pyrazole-4-carboxylic acid Openeye Name: 1-[3-[[5-methyl-1-(o-tolylmethyl)pyrazol-3-yl]amino]-3-oxo-propyl]pyrazole-4-carboxylic acid CAS Name: 1-[3-[[5-methyl-1-[(2-methylphenyl)methyl]-3-pyrazolyl]amino]-3-oxopropyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-[3-[[5-methyl-1-[(2-methylphenyl)methyl]pyrazol-3-yl]amino]-3-oxopropyl]pyrazole-4-carboxylic acid Traditional Name: 1-[3-keto-3-[[5-methyl-1-(2-methylbenzyl)pyrazol-3-yl]amino]propyl]pyrazole-4-carboxylic acid Formula: C19H21N5O3 MolecularWeight: 367.40174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C(=CC(=N2)NC(=O)CCN3C=C(C=N3)C(=O)O)C

Isomeric SMILES

CC1=CC=CC=C1CN2C(=CC(=N2)NC(=O)CCN3C=C(C=N3)C(=O)O)C

InChI

InChI=1S/C19H21N5O3/c1-13-5-3-4-6-15(13)12-24-14(2)9-17(22-24)21-18(25)7-8-23-11-16(10-20-23)19(26)27/h3-6,9-11H,7-8,12H2,1-2H3,(H,26,27)(H,21,22,25)