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[1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(8H)-one, 7-[(4-chlorophenyl)amino]-3-methyl-8-[(phenylmethylene)amino]-
SpectraBase Compound ID 4m5zq3HsuWF
InChI InChI=1S/C18H14ClN7O/c1-12-16(27)25-18(23-22-12)26(20-11-13-5-3-2-4-6-13)17(24-25)21-15-9-7-14(19)8-10-15/h2-11H,1H3,(H,21,24)/b20-11+
InChIKey KDWRGVNJVDZIAH-RGVLZGJSSA-N
Mol Weight 379.81 g/mol
Molecular Formula C18H14ClN7O
Exact Mass 379.094836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5wA62xj6bx9
Name [1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(8H)-one, 7-[(4-chlorophenyl)amino]-3-methyl-8-[(phenylmethylene)amino]-
CAS Registry Number 109071-92-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14ClN7O
InChI InChI=1S/C18H14ClN7O/c1-12-16(27)25-18(23-22-12)26(20-11-13-5-3-2-4-6-13)17(24-25)21-15-9-7-14(19)8-10-15/h2-11H,1H3,(H,21,24)/b20-11+
InChIKey KDWRGVNJVDZIAH-RGVLZGJSSA-N
Molecular Weight 379.811 g/mol
SMILES N(C1=NN2C(N1\N=C\c1ccccc1)=NN=C(C2=O)C)c1ccc(cc1)Cl
SPLASH splash10-004i-1595000000-6072b07f9e8d717b176e
Source of Spectrum KC-1986-2047-38
Synonyms 7-(4-Chloroanilino)-3-methyl-8-{[(E)-phenylmethylidene]amino}[1,2,4]triazolo[5,1-c][1,2,4]triazin-4(8H)-one 7-(4-Chloroanilino)-8-benzylideneamino-3-methyl[1,2,4]triazolo[5,1-c][1,2,4]triazin-4(8H)-one
Wiley ID 1359205