4-[2-(4-bromanyl-5-methyl-pyrazol-1-yl)propanoylamino]-1-ethyl-N-phenyl-pyrazole-3-carboxamide

Systemtic Name: 4-[2-(4-bromanyl-5-methyl-pyrazol-1-yl)propanoylamino]-1-ethyl-N-phenyl-pyrazole-3-carboxamide Openeye Name: 4-[2-(4-bromo-5-methyl-pyrazol-1-yl)propanoylamino]-1-ethyl-N-phenyl-pyrazole-3-carboxamide CAS Name: 4-[[2-(4-bromo-5-methyl-1-pyrazolyl)-1-oxopropyl]amino]-1-ethyl-N-phenyl-3-pyrazolecarboxamide IUPAC Name: 4-[2-(4-bromo-5-methylpyrazol-1-yl)propanoylamino]-1-ethyl-N-phenylpyrazole-3-carboxamide Traditional Name: 4-[2-(4-bromo-5-methyl-pyrazol-1-yl)propanoylamino]-1-ethyl-N-phenyl-pyrazole-3-carboxamide Formula: C19H21BrN6O2 MolecularWeight: 445.31304

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC2=CC=CC=C2)NC(=O)C(C)N3C(=C(C=N3)Br)C

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC2=CC=CC=C2)NC(=O)C(C)N3C(=C(C=N3)Br)C

InChI

InChI=1S/C19H21BrN6O2/c1-4-25-11-16(17(24-25)19(28)22-14-8-6-5-7-9-14)23-18(27)13(3)26-12(2)15(20)10-21-26/h5-11,13H,4H2,1-3H3,(H,22,28)(H,23,27)