1-methyl-5-[3-(4-methylpyrazol-1-yl)propylcarbamoyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-methyl-5-[3-(4-methylpyrazol-1-yl)propylcarbamoyl]pyrazole-4-carboxylic acid Openeye Name: 1-methyl-5-[3-(4-methylpyrazol-1-yl)propylcarbamoyl]pyrazole-4-carboxylic acid CAS Name: 1-methyl-5-[[3-(4-methyl-1-pyrazolyl)propylamino]-oxomethyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-methyl-5-[3-(4-methylpyrazol-1-yl)propylcarbamoyl]pyrazole-4-carboxylic acid Traditional Name: 1-methyl-5-[3-(4-methylpyrazol-1-yl)propylcarbamoyl]pyrazole-4-carboxylic acid Formula: C13H17N5O3 MolecularWeight: 291.30578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(N=C1)CCCNC(=O)C2=C(C=NN2C)C(=O)O

Isomeric SMILES

CC1=CN(N=C1)CCCNC(=O)C2=C(C=NN2C)C(=O)O

InChI

InChI=1S/C13H17N5O3/c1-9-6-16-18(8-9)5-3-4-14-12(19)11-10(13(20)21)7-15-17(11)2/h6-8H,3-5H2,1-2H3,(H,14,19)(H,20,21)