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2-[(7E)-3-(4-fluorophenyl)-7-[(4-fluorophenyl)methylene]-3a,4,5,6-tetrahydro-3H-indazol-2-yl]-N,N,4-trimethyl-thiazole-5-carboxamide

View entire compound with spectra: 1 MS (GC)

2-[(7E)-3-(4-fluorophenyl)-7-[(4-fluorophenyl)methylene]-3a,4,5,6-tetrahydro-3H-indazol-2-yl]-N,N,4-trimethyl-thiazole-5-carboxamide
SpectraBase Compound ID Bm3DTo95qJs
InChI InChI=1S/C27H26F2N4OS/c1-16-25(26(34)32(2)3)35-27(30-16)33-24(18-9-13-21(29)14-10-18)22-6-4-5-19(23(22)31-33)15-17-7-11-20(28)12-8-17/h7-15,22,24H,4-6H2,1-3H3/b19-15+
InChIKey CZENQEBSMFTWFN-XDJHFCHBSA-N
Mol Weight 492.59 g/mol
Molecular Formula C27H26F2N4OS
Exact Mass 492.179539 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4fh8xttZcip
Name 2-[(7E)-3-(4-fluorophenyl)-7-[(4-fluorophenyl)methylene]-3a,4,5,6-tetrahydro-3H-indazol-2-yl]-N,N,4-trimethyl-thiazole-5-carboxamide
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Formula C27H26F2N4OS
InChI InChI=1S/C27H26F2N4OS/c1-16-25(26(34)32(2)3)35-27(30-16)33-24(18-9-13-21(29)14-10-18)22-6-4-5-19(23(22)31-33)15-17-7-11-20(28)12-8-17/h7-15,22,24H,4-6H2,1-3H3/b19-15+
InChIKey CZENQEBSMFTWFN-XDJHFCHBSA-N
Molecular Weight 492.589 g/mol
SMILES c1(ccc(cc1)F)\C=C\1C=2C(CCC1)C(c1ccc(cc1)F)N(c1sc(c(n1)C)C(N(C)C)=O)N2
SPLASH splash10-0a5a-2910100000-099c65606292ed4e2931
Synonyms 2-[(7E)-3-(4-fluorophenyl)-7-[(4-fluorophenyl)methylidene]-3a,4,5,6-tetrahydro-3H-indazol-2-yl]-N,N,4-trimethyl-1,3-thiazole-5-carboxamide 2-[(7E)-3-(4-fluorophenyl)-7-[(4-fluorophenyl)methylidene]-3a,4,5,6-tetrahydro-3H-indazol-2-yl]-N,N,4-trimethyl-5-thiazolecarboxamide 2-[(7E)-7-(4-fluorobenzylidene)-3-(4-fluorophenyl)-3a,4,5,6-tetrahydro-3H-indazol-2-yl]-N,N,4-trimethyl-thiazole-5-carboxamide
Wiley ID 1463804