N-[1-[[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-4-pentyl-benzamide

Systemtic Name: N-[1-[[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-4-pentyl-benzamide Openeye Name: N-[1-benzyl-2-[[5-tert-butyl-2-(o-tolyl)pyrazol-3-yl]amino]-2-oxo-ethyl]-4-pentyl-benzamide CAS Name: N-[1-[[5-tert-butyl-2-(2-methylphenyl)-3-pyrazolyl]amino]-1-oxo-3-phenylpropan-2-yl]-4-pentylbenzamide IUPAC Name: N-[1-[[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]amino]-1-oxo-3-phenylpropan-2-yl]-4-pentylbenzamide Traditional Name: 4-amyl-N-[1-benzyl-2-[[5-tert-butyl-2-(o-tolyl)pyrazol-3-yl]amino]-2-keto-ethyl]benzamide Formula: C35H42N4O2 MolecularWeight: 550.73358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)NC3=CC(=NN3C4=CC=CC=C4C)C(C)(C)C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)NC3=CC(=NN3C4=CC=CC=C4C)C(C)(C)C

InChI

InChI=1S/C35H42N4O2/c1-6-7-9-15-26-19-21-28(22-20-26)33(40)36-29(23-27-16-10-8-11-17-27)34(41)37-32-24-31(35(3,4)5)38-39(32)30-18-13-12-14-25(30)2/h8,10-14,16-22,24,29H,6-7,9,15,23H2,1-5H3,(H,36,40)(H,37,41)