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

Systemtic Name: 4-[2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propanoylamino]-1-ethyl-N-phenyl-pyrazole-3-carboxamide Openeye Name: 4-[2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propanoylamino]-1-ethyl-N-phenyl-pyrazole-3-carboxamide CAS Name: 4-[[2-(4-bromo-3,5-dimethyl-1-pyrazolyl)-1-oxopropyl]amino]-1-ethyl-N-phenyl-3-pyrazolecarboxamide IUPAC Name: 4-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)propanoylamino]-1-ethyl-N-phenylpyrazole-3-carboxamide Traditional Name: 4-[2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propanoylamino]-1-ethyl-N-phenyl-pyrazole-3-carboxamide Formula: C20H23BrN6O2 MolecularWeight: 459.33962

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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)C)Br)C

Isomeric SMILES

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

InChI

InChI=1S/C20H23BrN6O2/c1-5-26-11-16(18(25-26)20(29)22-15-9-7-6-8-10-15)23-19(28)14(4)27-13(3)17(21)12(2)24-27/h6-11,14H,5H2,1-4H3,(H,22,29)(H,23,28)