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1-[[(3-amino-1H-1,2,4-triazol-5-yl)acetyl](propyl)amino]-N-(2,6-dimethylphenyl)cyclohexanecarboxamide
SpectraBase Compound ID AT8dWJCTqux
InChI InChI=1S/C22H32N6O2/c1-4-13-28(18(29)14-17-24-21(23)27-26-17)22(11-6-5-7-12-22)20(30)25-19-15(2)9-8-10-16(19)3/h8-10H,4-7,11-14H2,1-3H3,(H,25,30)(H3,23,24,26,27)
InChIKey PJKCSBWQCIVFQO-UHFFFAOYSA-N
Mol Weight 412.5 g/mol
Molecular Formula C22H32N6O2
Exact Mass 412.258674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GbSbQQGbSvn
Name 1-[[(3-amino-1H-1,2,4-triazol-5-yl)acetyl](propyl)amino]-N-(2,6-dimethylphenyl)cyclohexanecarboxamide
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Formula C22H32N6O2
InChI InChI=1S/C22H32N6O2/c1-4-13-28(18(29)14-17-24-21(23)27-26-17)22(11-6-5-7-12-22)20(30)25-19-15(2)9-8-10-16(19)3/h8-10H,4-7,11-14H2,1-3H3,(H,25,30)(H3,23,24,26,27)
InChIKey PJKCSBWQCIVFQO-UHFFFAOYSA-N
Molecular Weight 412.538 g/mol
SMILES N(C(C1(N(C(Cc2nc(n[nH]2)N)=O)CCC)CCCCC1)=O)c1c(cccc1C)C
SPLASH splash10-0006-2940000000-7080d37487448cce8725
Synonyms 1-[2-(3-azanyl-1H-1,2,4-triazol-5-yl)ethanoyl-propyl-amino]-N-(2,6-dimethylphenyl)cyclohexane-1-carboxamide 1-[[2-(3-amino-1H-1,2,4-triazol-5-yl)-1-oxoethyl]-propylamino]-N-(2,6-dimethylphenyl)-1-cyclohexanecarboxamide 1-[[2-(3-amino-1H-1,2,4-triazol-5-yl)acetyl]-propyl-amino]-N-(2,6-dimethylphenyl)cyclohexanecarboxamide 1-[[2-(3-amino-1H-1,2,4-triazol-5-yl)acetyl]-propylamino]-N-(2,6-dimethylphenyl)cyclohexane-1-carboxamide
Wiley ID 1462513