4-(4-bromophenyl)-4-oxidanylidene-N-[2-(4-pyrazol-1-ylphenyl)ethyl]butanamide

Systemtic Name: 4-(4-bromophenyl)-4-oxidanylidene-N-[2-(4-pyrazol-1-ylphenyl)ethyl]butanamide Openeye Name: 4-(4-bromophenyl)-4-oxo-N-[2-(4-pyrazol-1-ylphenyl)ethyl]butanamide CAS Name: 4-(4-bromophenyl)-4-oxo-N-[2-[4-(1-pyrazolyl)phenyl]ethyl]butanamide IUPAC Name: 4-(4-bromophenyl)-4-oxo-N-[2-(4-pyrazol-1-ylphenyl)ethyl]butanamide Traditional Name: 4-(4-bromophenyl)-4-keto-N-[2-(4-pyrazol-1-ylphenyl)ethyl]butyramide Formula: C21H20BrN3O2 MolecularWeight: 426.3064

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=CC=C(C=C2)CCNC(=O)CCC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CN(N=C1)C2=CC=C(C=C2)CCNC(=O)CCC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H20BrN3O2/c22-18-6-4-17(5-7-18)20(26)10-11-21(27)23-14-12-16-2-8-19(9-3-16)25-15-1-13-24-25/h1-9,13,15H,10-12,14H2,(H,23,27)