4-[2-(4-bromanylpyrazol-1-yl)propanoylamino]-1-ethyl-N-(2-methylpropyl)pyrazole-3-carboxamide

Systemtic Name: 4-[2-(4-bromanylpyrazol-1-yl)propanoylamino]-1-ethyl-N-(2-methylpropyl)pyrazole-3-carboxamide Openeye Name: 4-[2-(4-bromopyrazol-1-yl)propanoylamino]-1-ethyl-N-isobutyl-pyrazole-3-carboxamide CAS Name: 4-[[2-(4-bromo-1-pyrazolyl)-1-oxopropyl]amino]-1-ethyl-N-(2-methylpropyl)-3-pyrazolecarboxamide IUPAC Name: 4-[2-(4-bromopyrazol-1-yl)propanoylamino]-1-ethyl-N-(2-methylpropyl)pyrazole-3-carboxamide Traditional Name: 4-[2-(4-bromopyrazol-1-yl)propanoylamino]-1-ethyl-N-isobutyl-pyrazole-3-carboxamide Formula: C16H23BrN6O2 MolecularWeight: 411.29682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NCC(C)C)NC(=O)C(C)N2C=C(C=N2)Br

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NCC(C)C)NC(=O)C(C)N2C=C(C=N2)Br

InChI

InChI=1S/C16H23BrN6O2/c1-5-22-9-13(14(21-22)16(25)18-6-10(2)3)20-15(24)11(4)23-8-12(17)7-19-23/h7-11H,5-6H2,1-4H3,(H,18,25)(H,20,24)