N5,N5-dibutyl-N3-[(2S,3R)-3-oxidanyl-1-phenyl-4-[[3-(trifluoromethyl)phenyl]methylamino]butan-2-yl]-1-(phenylmethyl)pyrazole-3,5-dicarboxamide

Systemtic Name: N5,N5-dibutyl-N3-[(2S,3R)-3-oxidanyl-1-phenyl-4-[[3-(trifluoromethyl)phenyl]methylamino]butan-2-yl]-1-(phenylmethyl)pyrazole-3,5-dicarboxamide Openeye Name: 1-benzyl-N3-[(1S,2R)-1-benzyl-2-hydroxy-3-[[3-(trifluoromethyl)phenyl]methylamino]propyl]-N5,N5-dibutyl-pyrazole-3,5-dicarboxamide CAS Name: N5,N5-dibutyl-N3-[(2S,3R)-3-hydroxy-1-phenyl-4-[[3-(trifluoromethyl)phenyl]methylamino]butan-2-yl]-1-(phenylmethyl)pyrazole-3,5-dicarboxamide IUPAC Name: 1-benzyl-5-N,5-N-dibutyl-3-N-[(2S,3R)-3-hydroxy-1-phenyl-4-[[3-(trifluoromethyl)phenyl]methylamino]butan-2-yl]pyrazole-3,5-dicarboxamide Traditional Name: 1-benzyl-N-[(1S,2R)-1-benzyl-2-hydroxy-3-[[3-(trifluoromethyl)benzyl]amino]propyl]-N',N'-dibutyl-pyrazole-3,5-dicarboxamide Formula: C38H46F3N5O3 MolecularWeight: 677.79875

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(=O)C1=CC(=NN1CC2=CC=CC=C2)C(=O)NC(CC3=CC=CC=C3)C(CNCC4=CC(=CC=C4)C(F)(F)F)O

Isomeric SMILES

CCCCN(CCCC)C(=O)C1=CC(=NN1CC2=CC=CC=C2)C(=O)N[C@@H](CC3=CC=CC=C3)[C@@H](CNCC4=CC(=CC=C4)C(F)(F)F)O

InChI

InChI=1S/C38H46F3N5O3/c1-3-5-20-45(21-6-4-2)37(49)34-24-33(44-46(34)27-29-16-11-8-12-17-29)36(48)43-32(23-28-14-9-7-10-15-28)35(47)26-42-25-30-18-13-19-31(22-30)38(39,40)41/h7-19,22,24,32,35,42,47H,3-6,20-21,23,25-27H2,1-2H3,(H,43,48)/t32-,35+/m0/s1