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[1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(8H)-one, 7-[(4-chlorophenyl)amino]-8-[[(3,4-dimethoxyphenyl)methylene]amino]-3-methyl-

View entire compound with spectra: 1 MS (GC)

[1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(8H)-one, 7-[(4-chlorophenyl)amino]-8-[[(3,4-dimethoxyphenyl)methylene]amino]-3-methyl-
SpectraBase Compound ID GlO5do1KPhB
InChI InChI=1S/C20H18ClN7O3/c1-12-18(29)27-20(25-24-12)28(19(26-27)23-15-7-5-14(21)6-8-15)22-11-13-4-9-16(30-2)17(10-13)31-3/h4-11H,1-3H3,(H,23,26)/b22-11+
InChIKey ZQIKFLLFDYSHIN-SSDVNMTOSA-N
Mol Weight 439.86 g/mol
Molecular Formula C20H18ClN7O3
Exact Mass 439.115965 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AZne7GBNiPN
Name [1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(8H)-one, 7-[(4-chlorophenyl)amino]-8-[[(3,4-dimethoxyphenyl)methylene]amino]-3-methyl-
CAS Registry Number 109071-99-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18ClN7O3
InChI InChI=1S/C20H18ClN7O3/c1-12-18(29)27-20(25-24-12)28(19(26-27)23-15-7-5-14(21)6-8-15)22-11-13-4-9-16(30-2)17(10-13)31-3/h4-11H,1-3H3,(H,23,26)/b22-11+
InChIKey ZQIKFLLFDYSHIN-SSDVNMTOSA-N
Molecular Weight 439.863 g/mol
SMILES N(C1=NN2C(N1\N=C\c1cc(OC)c(cc1)OC)=NN=C(C2=O)C)c1ccc(cc1)Cl
SPLASH splash10-004i-0149100000-bc9a94ef9a36625d6c48
Source of Spectrum KC-1986-2047-45
Synonyms 7-(4-Chloroanilino)-8-(3,4-dimethoxybenzylideneamino)-3-methyl[1,2,4]triazolo[5,1-c][1,2,4]triazin-4(8H)-one 7-(4-Chloroanilino)-8-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}-3-methyl[1,2,4]triazolo[5,1-c][1,2,4]triazin-4(8H)-one
Wiley ID 1384381