4-bromanyl-N-[(1R)-1-(2,4-dimethylphenyl)ethyl]-2-ethyl-pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-N-[(1R)-1-(2,4-dimethylphenyl)ethyl]-2-ethyl-pyrazole-3-carboxamide Openeye Name: 4-bromo-N-[(1R)-1-(2,4-dimethylphenyl)ethyl]-2-ethyl-pyrazole-3-carboxamide CAS Name: 4-bromo-N-[(1R)-1-(2,4-dimethylphenyl)ethyl]-2-ethyl-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-[(1R)-1-(2,4-dimethylphenyl)ethyl]-2-ethylpyrazole-3-carboxamide Traditional Name: 4-bromo-N-[(1R)-1-(2,4-dimethylphenyl)ethyl]-2-ethyl-pyrazole-3-carboxamide Formula: C16H20BrN3O MolecularWeight: 350.2535

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)Br)C(=O)NC(C)C2=C(C=C(C=C2)C)C

Isomeric SMILES

CCN1C(=C(C=N1)Br)C(=O)N[C@H](C)C2=C(C=C(C=C2)C)C

InChI

InChI=1S/C16H20BrN3O/c1-5-20-15(14(17)9-18-20)16(21)19-12(4)13-7-6-10(2)8-11(13)3/h6-9,12H,5H2,1-4H3,(H,19,21)/t12-/m1/s1