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1-(N-[2-(3-amino-1H-1,2,4-triazol-5-yl)-1-oxoethyl]-4-methylanilino)-N-(2-methylphenyl)-1-cyclohexanecarboxamide
SpectraBase Compound ID GQvikSv3r42
InChI InChI=1S/C25H30N6O2/c1-17-10-12-19(13-11-17)31(22(32)16-21-28-24(26)30-29-21)25(14-6-3-7-15-25)23(33)27-20-9-5-4-8-18(20)2/h4-5,8-13H,3,6-7,14-16H2,1-2H3,(H,27,33)(H3,26,28,29,30)
InChIKey FYGFQFAMNTWMSS-UHFFFAOYSA-N
Mol Weight 446.56 g/mol
Molecular Formula C25H30N6O2
Exact Mass 446.243024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BlPZaMhe8wb
Name 1-(N-[2-(3-amino-1H-1,2,4-triazol-5-yl)-1-oxoethyl]-4-methylanilino)-N-(2-methylphenyl)-1-cyclohexanecarboxamide
Alternate Name(s) 1-(N-[2-(3-amino-1H-1,2,4-triazol-5-yl)acetyl]-4-methyl-anilino)-N-(o-tolyl)cyclohexanecarboxamide 1-(N-[2-(3-amino-1H-1,2,4-triazol-5-yl)acetyl]-4-methylanilino)-N-(2-methylphenyl)cyclohexane-1-carboxamide 1-[2-(3-azanyl-1H-1,2,4-triazol-5-yl)ethanoyl-(4-methylphenyl)amino]-N-(2-methylphenyl)cyclohexane-1-carboxamide
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Formula C25H30N6O2
InChI InChI=1S/C25H30N6O2/c1-17-10-12-19(13-11-17)31(22(32)16-21-28-24(26)30-29-21)25(14-6-3-7-15-25)23(33)27-20-9-5-4-8-18(20)2/h4-5,8-13H,3,6-7,14-16H2,1-2H3,(H,27,33)(H3,26,28,29,30)
InChIKey FYGFQFAMNTWMSS-UHFFFAOYSA-N
Molecular Weight 446.555 g/mol
SMILES N(C(C1(N(C(Cc2nc(n[nH]2)N)=O)c2ccc(cc2)C)CCCCC1)=O)c1c(C)cccc1
SPLASH splash10-000g-9500000000-147ba78dfe93932c44b3
Wiley ID 1466285