2-[3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylamino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid

Systemtic Name: 2-[3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylamino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid Openeye Name: 2-[3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylamino]-3-oxo-propyl]pyrazole-3-carboxylic acid CAS Name: 2-[3-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methylamino]-3-oxopropyl]-3-pyrazolecarboxylic acid IUPAC Name: 2-[3-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methylamino]-3-oxopropyl]pyrazole-3-carboxylic acid Traditional Name: 2-[3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylamino]-3-keto-propyl]pyrazole-3-carboxylic acid Formula: C19H21N5O3 MolecularWeight: 367.40174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)CCN3C(=CC=N3)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)CCN3C(=CC=N3)C(=O)O

InChI

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