3-bromanyl-N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]benzamide

Systemtic Name: 3-bromanyl-N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]benzamide Openeye Name: 3-bromo-N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]benzamide CAS Name: 3-bromo-N-[5-tert-butyl-2-(4-methoxyphenyl)-3-pyrazolyl]benzamide IUPAC Name: 3-bromo-N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]benzamide Traditional Name: 3-bromo-N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]benzamide Formula: C21H22BrN3O2 MolecularWeight: 428.32228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)C2=CC(=CC=C2)Br)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)C2=CC(=CC=C2)Br)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H22BrN3O2/c1-21(2,3)18-13-19(23-20(26)14-6-5-7-15(22)12-14)25(24-18)16-8-10-17(27-4)11-9-16/h5-13H,1-4H3,(H,23,26)