2-[3-[[1-ethyl-3-(propylcarbamoyl)pyrazol-4-yl]amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid

Systemtic Name: 2-[3-[[1-ethyl-3-(propylcarbamoyl)pyrazol-4-yl]amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid Openeye Name: 2-[3-[[1-ethyl-3-(propylcarbamoyl)pyrazol-4-yl]amino]-3-oxo-propyl]pyrazole-3-carboxylic acid CAS Name: 2-[3-[[1-ethyl-3-[oxo(propylamino)methyl]-4-pyrazolyl]amino]-3-oxopropyl]-3-pyrazolecarboxylic acid IUPAC Name: 2-[3-[[1-ethyl-3-(propylcarbamoyl)pyrazol-4-yl]amino]-3-oxopropyl]pyrazole-3-carboxylic acid Traditional Name: 2-[3-[[1-ethyl-3-(propylcarbamoyl)pyrazol-4-yl]amino]-3-keto-propyl]pyrazole-3-carboxylic acid Formula: C16H22N6O4 MolecularWeight: 362.38368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=NN(C=C1NC(=O)CCN2C(=CC=N2)C(=O)O)CC

Isomeric SMILES

CCCNC(=O)C1=NN(C=C1NC(=O)CCN2C(=CC=N2)C(=O)O)CC

InChI

InChI=1S/C16H22N6O4/c1-3-7-17-15(24)14-11(10-21(4-2)20-14)19-13(23)6-9-22-12(16(25)26)5-8-18-22/h5,8,10H,3-4,6-7,9H2,1-2H3,(H,17,24)(H,19,23)(H,25,26)