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3H-1,2,4-triazole-3-thione, 5-[(2,4-dichlorophenoxy)methyl]-2,4-dihydro-4-(2-methylphenyl)-2-(4-morpholinylmethyl)-
SpectraBase Compound ID 1SmXkbEfoXB
InChI InChI=1S/C21H22Cl2N4O2S/c1-15-4-2-3-5-18(15)27-20(13-29-19-7-6-16(22)12-17(19)23)24-26(21(27)30)14-25-8-10-28-11-9-25/h2-7,12H,8-11,13-14H2,1H3
InChIKey FXOJASLMDOZLEM-UHFFFAOYSA-N
Mol Weight 465.4 g/mol
Molecular Formula C21H22Cl2N4O2S
Exact Mass 464.084053 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E39jKp3k7mW
Name 5-[(2,4-dichlorophenoxy)methyl]-2-(morpholinomethyl)-4-(o-tolyl)-1,2,4-triazole-3-thione
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Formula C21H22Cl2N4O2S
InChI InChI=1S/C21H22Cl2N4O2S/c1-15-4-2-3-5-18(15)27-20(13-29-19-7-6-16(22)12-17(19)23)24-26(21(27)30)14-25-8-10-28-11-9-25/h2-7,12H,8-11,13-14H2,1H3
InChIKey FXOJASLMDOZLEM-UHFFFAOYSA-N
Molecular Weight 465.399 g/mol
SMILES c1ccc(N2C(N(CN3CCOCC3)N=C2COc2c(cc(cc2)Cl)Cl)=S)c(C)c1
SPLASH splash10-0udi-1900000000-f389c1f732ed06f3e9e5
Synonyms 5-[(2,4-dichlorophenoxy)methyl]-4-(2-methylphenyl)-2-(4-morpholinylmethyl)-1,2,4-triazole-3-thione 5-[(2,4-dichlorophenoxy)methyl]-4-(2-methylphenyl)-2-(morpholin-4-ylmethyl)-1,2,4-triazole-3-thione 5-[[2,4-bis(chloranyl)phenoxy]methyl]-4-(2-methylphenyl)-2-(morpholin-4-ylmethyl)-1,2,4-triazole-3-thione
Wiley ID 1436333