4-[[(2S)-2-[4-bromanyl-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanoyl]amino]-2-methyl-N-propyl-pyrazole-3-carboxamide

Systemtic Name: 4-[[(2S)-2-[4-bromanyl-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanoyl]amino]-2-methyl-N-propyl-pyrazole-3-carboxamide Openeye Name: 4-[[(2S)-2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanoyl]amino]-2-methyl-N-propyl-pyrazole-3-carboxamide CAS Name: 4-[[(2S)-2-[4-bromo-5-methyl-3-(trifluoromethyl)-1-pyrazolyl]-1-oxopropyl]amino]-2-methyl-N-propyl-3-pyrazolecarboxamide IUPAC Name: 4-[[(2S)-2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanoyl]amino]-2-methyl-N-propylpyrazole-3-carboxamide Traditional Name: 4-[[(2S)-2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanoyl]amino]-2-methyl-N-propyl-pyrazole-3-carboxamide Formula: C16H20BrF3N6O2 MolecularWeight: 465.26821

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=C(C=NN1C)NC(=O)C(C)N2C(=C(C(=N2)C(F)(F)F)Br)C

Isomeric SMILES

CCCNC(=O)C1=C(C=NN1C)NC(=O)[C@H](C)N2C(=C(C(=N2)C(F)(F)F)Br)C

InChI

InChI=1S/C16H20BrF3N6O2/c1-5-6-21-15(28)12-10(7-22-25(12)4)23-14(27)9(3)26-8(2)11(17)13(24-26)16(18,19)20/h7,9H,5-6H2,1-4H3,(H,21,28)(H,23,27)/t9-/m0/s1