1-[(2R)-1-[3-(5-methylpyrazol-1-yl)propylamino]-1-oxidanylidene-propan-2-yl]pyrazole-4-carboxylic acid

Systemtic Name: 1-[(2R)-1-[3-(5-methylpyrazol-1-yl)propylamino]-1-oxidanylidene-propan-2-yl]pyrazole-4-carboxylic acid Openeye Name: 1-[(1R)-1-methyl-2-[3-(5-methylpyrazol-1-yl)propylamino]-2-oxo-ethyl]pyrazole-4-carboxylic acid CAS Name: 1-[(2R)-1-[3-(5-methyl-1-pyrazolyl)propylamino]-1-oxopropan-2-yl]-4-pyrazolecarboxylic acid IUPAC Name: 1-[(2R)-1-[3-(5-methylpyrazol-1-yl)propylamino]-1-oxopropan-2-yl]pyrazole-4-carboxylic acid Traditional Name: 1-[(1R)-2-keto-1-methyl-2-[3-(5-methylpyrazol-1-yl)propylamino]ethyl]pyrazole-4-carboxylic acid Formula: C14H19N5O3 MolecularWeight: 305.33236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=NN1CCCNC(=O)C(C)N2C=C(C=N2)C(=O)O

Isomeric SMILES

CC1=CC=NN1CCCNC(=O)[C@@H](C)N2C=C(C=N2)C(=O)O

InChI

InChI=1S/C14H19N5O3/c1-10-4-6-16-18(10)7-3-5-15-13(20)11(2)19-9-12(8-17-19)14(21)22/h4,6,8-9,11H,3,5,7H2,1-2H3,(H,15,20)(H,21,22)/t11-/m1/s1