4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-ethyl-N-phenyl-benzamide

Systemtic Name: 4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-ethyl-N-phenyl-benzamide Openeye Name: 4-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-ethyl-N-phenyl-benzamide CAS Name: 4-(4-bromo-3,5-dimethyl-1-pyrazolyl)-N-ethyl-N-phenylbenzamide IUPAC Name: 4-(4-bromo-3,5-dimethylpyrazol-1-yl)-N-ethyl-N-phenylbenzamide Traditional Name: 4-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-ethyl-N-phenyl-benzamide Formula: C20H20BrN3O MolecularWeight: 398.2963

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=O)C2=CC=C(C=C2)N3C(=C(C(=N3)C)Br)C

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)C2=CC=C(C=C2)N3C(=C(C(=N3)C)Br)C

InChI

InChI=1S/C20H20BrN3O/c1-4-23(17-8-6-5-7-9-17)20(25)16-10-12-18(13-11-16)24-15(3)19(21)14(2)22-24/h5-13H,4H2,1-3H3