N-[3-[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropyl]-1,3-diphenyl-pyrazole-4-carboxamide

Systemtic Name: N-[3-[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropyl]-1,3-diphenyl-pyrazole-4-carboxamide Openeye Name: N-[3-[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropyl]-1,3-diphenyl-pyrazole-4-carboxamide CAS Name: N-[3-[[4-tert-butyl-6-(trifluoromethyl)-2-pyrimidinyl]thio]propyl]-1,3-diphenyl-4-pyrazolecarboxamide IUPAC Name: N-[3-[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropyl]-1,3-diphenylpyrazole-4-carboxamide Traditional Name: N-[3-[[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]thio]propyl]-1,3-diphenyl-pyrazole-4-carboxamide Formula: C28H28F3N5OS MolecularWeight: 539.61503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NC(=N1)SCCCNC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC(=NC(=N1)SCCCNC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C(F)(F)F

InChI

InChI=1S/C28H28F3N5OS/c1-27(2,3)22-17-23(28(29,30)31)34-26(33-22)38-16-10-15-32-25(37)21-18-36(20-13-8-5-9-14-20)35-24(21)19-11-6-4-7-12-19/h4-9,11-14,17-18H,10,15-16H2,1-3H3,(H,32,37)