2-bromanyl-N-butyl-N-[2-[(5-tert-butyl-2-methyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 2-bromanyl-N-butyl-N-[2-[(5-tert-butyl-2-methyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl]benzamide Openeye Name: 2-bromo-N-butyl-N-[2-[(5-tert-butyl-2-methyl-pyrazol-3-yl)amino]-2-oxo-ethyl]benzamide CAS Name: 2-bromo-N-butyl-N-[2-[(5-tert-butyl-2-methyl-3-pyrazolyl)amino]-2-oxoethyl]benzamide IUPAC Name: 2-bromo-N-butyl-N-[2-[(5-tert-butyl-2-methylpyrazol-3-yl)amino]-2-oxoethyl]benzamide Traditional Name: 2-bromo-N-butyl-N-[2-[(5-tert-butyl-2-methyl-pyrazol-3-yl)amino]-2-keto-ethyl]benzamide Formula: C21H29BrN4O2 MolecularWeight: 449.38456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)NC1=CC(=NN1C)C(C)(C)C)C(=O)C2=CC=CC=C2Br

Isomeric SMILES

CCCCN(CC(=O)NC1=CC(=NN1C)C(C)(C)C)C(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C21H29BrN4O2/c1-6-7-12-26(20(28)15-10-8-9-11-16(15)22)14-19(27)23-18-13-17(21(2,3)4)24-25(18)5/h8-11,13H,6-7,12,14H2,1-5H3,(H,23,27)