1-[3-[2-(3,5-dimethylpyrazol-1-yl)ethylamino]-3-oxidanylidene-propyl]pyrazole-3-carboxylate

Systemtic Name: 1-[3-[2-(3,5-dimethylpyrazol-1-yl)ethylamino]-3-oxidanylidene-propyl]pyrazole-3-carboxylate Openeye Name: 1-[3-[2-(3,5-dimethylpyrazol-1-yl)ethylamino]-3-oxo-propyl]pyrazole-3-carboxylate CAS Name: 1-[3-[2-(3,5-dimethyl-1-pyrazolyl)ethylamino]-3-oxopropyl]-3-pyrazolecarboxylate IUPAC Name: 1-[3-[2-(3,5-dimethylpyrazol-1-yl)ethylamino]-3-oxopropyl]pyrazole-3-carboxylate Traditional Name: 1-[3-[2-(3,5-dimethylpyrazol-1-yl)ethylamino]-3-keto-propyl]pyrazole-3-carboxylate Formula: C14H18N5O3- MolecularWeight: 304.32442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCNC(=O)CCN2C=CC(=N2)C(=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1CCNC(=O)CCN2C=CC(=N2)C(=O)[O-])C

InChI

InChI=1S/C14H19N5O3/c1-10-9-11(2)19(16-10)8-5-15-13(20)4-7-18-6-3-12(17-18)14(21)22/h3,6,9H,4-5,7-8H2,1-2H3,(H,15,20)(H,21,22)/p-1