N-[2-[[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-N-propan-2-yl-adamantane-1-carboxamide

Systemtic Name: N-[2-[[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-N-propan-2-yl-adamantane-1-carboxamide Openeye Name: N-[2-[[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxo-ethyl]-N-isopropyl-adamantane-1-carboxamide CAS Name: N-[2-[[2-(4-fluorophenyl)-5-phenyl-3-pyrazolyl]amino]-2-oxoethyl]-N-propan-2-yl-1-adamantanecarboxamide IUPAC Name: N-[2-[[2-(4-fluorophenyl)-5-phenylpyrazol-3-yl]amino]-2-oxoethyl]-N-propan-2-yladamantane-1-carboxamide Traditional Name: N-[2-[[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-keto-ethyl]-N-isopropyl-adamantane-1-carboxamide Formula: C31H35FN4O2 MolecularWeight: 514.633603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)F)C3=CC=CC=C3)C(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC(C)N(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)F)C3=CC=CC=C3)C(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C31H35FN4O2/c1-20(2)35(30(38)31-16-21-12-22(17-31)14-23(13-21)18-31)19-29(37)33-28-15-27(24-6-4-3-5-7-24)34-36(28)26-10-8-25(32)9-11-26/h3-11,15,20-23H,12-14,16-19H2,1-2H3,(H,33,37)