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

Systemtic Name: 3-bromanyl-N-[2-[[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-N-pentyl-benzamide Openeye Name: 3-bromo-N-[2-[[5-tert-butyl-2-(o-tolyl)pyrazol-3-yl]amino]-2-oxo-ethyl]-N-pentyl-benzamide CAS Name: 3-bromo-N-[2-[[5-tert-butyl-2-(2-methylphenyl)-3-pyrazolyl]amino]-2-oxoethyl]-N-pentylbenzamide IUPAC Name: 3-bromo-N-[2-[[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]amino]-2-oxoethyl]-N-pentylbenzamide Traditional Name: N-amyl-3-bromo-N-[2-[[5-tert-butyl-2-(o-tolyl)pyrazol-3-yl]amino]-2-keto-ethyl]benzamide Formula: C28H35BrN4O2 MolecularWeight: 539.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC(=O)NC1=CC(=NN1C2=CC=CC=C2C)C(C)(C)C)C(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CCCCCN(CC(=O)NC1=CC(=NN1C2=CC=CC=C2C)C(C)(C)C)C(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C28H35BrN4O2/c1-6-7-10-16-32(27(35)21-13-11-14-22(29)17-21)19-26(34)30-25-18-24(28(3,4)5)31-33(25)23-15-9-8-12-20(23)2/h8-9,11-15,17-18H,6-7,10,16,19H2,1-5H3,(H,30,34)