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5-[2-[(3-Fluorophenyl)carbonyl-(phenylmethyl)amino]ethanoylamino]-2-phenyl-1,2,3-triazole-4-carboxamide
SpectraBase Compound ID BR6QQCUEMTl
InChI InChI=1S/C25H21FN6O3/c26-19-11-7-10-18(14-19)25(35)31(15-17-8-3-1-4-9-17)16-21(33)28-24-22(23(27)34)29-32(30-24)20-12-5-2-6-13-20/h1-14H,15-16H2,(H2,27,34)(H,28,30,33)
InChIKey ZHJKEBJSBVLYCS-UHFFFAOYSA-N
Mol Weight 472.48 g/mol
Molecular Formula C25H21FN6O3
Exact Mass 472.165917 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4eBv128RzDn
Name 5-[2-[(3-fluorophenyl)carbonyl-(phenylmethyl)amino]ethanoylamino]-2-phenyl-1,2,3-triazole-4-carboxamide
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Formula C25H21FN6O3
InChI InChI=1S/C25H21FN6O3/c26-19-11-7-10-18(14-19)25(35)31(15-17-8-3-1-4-9-17)16-21(33)28-24-22(23(27)34)29-32(30-24)20-12-5-2-6-13-20/h1-14H,15-16H2,(H2,27,34)(H,28,30,33)
InChIKey ZHJKEBJSBVLYCS-UHFFFAOYSA-N
Molecular Weight 472.480 g/mol
SMILES NC(c1n[n](nc1NC(CN(C(c1cc(F)ccc1)=O)Cc1ccccc1)=O)-c1ccccc1)=O
SPLASH splash10-00dm-9640000000-af3538ded66cb7101cf5
Synonyms 5-[[2-[benzyl-(3-fluorobenzoyl)amino]acetyl]amino]-2-phenyl-triazole-4-carboxamide 5-[[2-[[(3-fluorophenyl)-oxomethyl]-(phenylmethyl)amino]-1-oxoethyl]amino]-2-phenyl-4-triazolecarboxamide
Wiley ID 1445574