2-[3-[2-[2-(5-methylpyrazol-1-yl)ethanoylamino]ethylamino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid

Systemtic Name: 2-[3-[2-[2-(5-methylpyrazol-1-yl)ethanoylamino]ethylamino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid Openeye Name: 2-[3-[2-[[2-(5-methylpyrazol-1-yl)acetyl]amino]ethylamino]-3-oxo-propyl]pyrazole-3-carboxylic acid CAS Name: 2-[3-[2-[[2-(5-methyl-1-pyrazolyl)-1-oxoethyl]amino]ethylamino]-3-oxopropyl]-3-pyrazolecarboxylic acid IUPAC Name: 2-[3-[2-[[2-(5-methylpyrazol-1-yl)acetyl]amino]ethylamino]-3-oxopropyl]pyrazole-3-carboxylic acid Traditional Name: 2-[3-keto-3-[2-[[2-(5-methylpyrazol-1-yl)acetyl]amino]ethylamino]propyl]pyrazole-3-carboxylic acid Formula: C15H20N6O4 MolecularWeight: 348.3571

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=NN1CC(=O)NCCNC(=O)CCN2C(=CC=N2)C(=O)O

Isomeric SMILES

CC1=CC=NN1CC(=O)NCCNC(=O)CCN2C(=CC=N2)C(=O)O

InChI

InChI=1S/C15H20N6O4/c1-11-2-5-19-21(11)10-14(23)17-8-7-16-13(22)4-9-20-12(15(24)25)3-6-18-20/h2-3,5-6H,4,7-10H2,1H3,(H,16,22)(H,17,23)(H,24,25)