N-[(1S)-1-(2-bromophenyl)ethyl]-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-oxidanylidene-ethanamide

Systemtic Name: N-[(1S)-1-(2-bromophenyl)ethyl]-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-oxidanylidene-ethanamide Openeye Name: N-[(1S)-1-(2-bromophenyl)ethyl]-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-oxo-acetamide CAS Name: N-[(1S)-1-(2-bromophenyl)ethyl]-2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-oxoacetamide IUPAC Name: N-[(1S)-1-(2-bromophenyl)ethyl]-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-oxoacetamide Traditional Name: N-[(1S)-1-(2-bromophenyl)ethyl]-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-keto-acetamide Formula: C21H20BrN3O2 MolecularWeight: 426.3064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)C(=O)NC(C)C3=CC=CC=C3Br

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)C(=O)N[C@@H](C)C3=CC=CC=C3Br

InChI

InChI=1S/C21H20BrN3O2/c1-13(17-11-7-8-12-18(17)22)23-21(27)20(26)19-14(2)24-25(15(19)3)16-9-5-4-6-10-16/h4-13H,1-3H3,(H,23,27)/t13-/m0/s1