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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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