N-[2-[[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-4-hexyl-N-propan-2-yl-benzamide

Systemtic Name: N-[2-[[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-4-hexyl-N-propan-2-yl-benzamide Openeye Name: N-[2-[[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxo-ethyl]-4-hexyl-N-isopropyl-benzamide CAS Name: N-[2-[[2-(4-fluorophenyl)-5-phenyl-3-pyrazolyl]amino]-2-oxoethyl]-4-hexyl-N-propan-2-ylbenzamide IUPAC Name: N-[2-[[2-(4-fluorophenyl)-5-phenylpyrazol-3-yl]amino]-2-oxoethyl]-4-hexyl-N-propan-2-ylbenzamide Traditional Name: N-[2-[[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-keto-ethyl]-4-hexyl-N-isopropyl-benzamide Formula: C33H37FN4O2 MolecularWeight: 540.670883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)N(CC(=O)NC2=CC(=NN2C3=CC=C(C=C3)F)C4=CC=CC=C4)C(C)C

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)N(CC(=O)NC2=CC(=NN2C3=CC=C(C=C3)F)C4=CC=CC=C4)C(C)C

InChI

InChI=1S/C33H37FN4O2/c1-4-5-6-8-11-25-14-16-27(17-15-25)33(40)37(24(2)3)23-32(39)35-31-22-30(26-12-9-7-10-13-26)36-38(31)29-20-18-28(34)19-21-29/h7,9-10,12-22,24H,4-6,8,11,23H2,1-3H3,(H,35,39)