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2-(p-Anisyl)-5-methyl-4-[4-(p-nitrophenyl)thiazol-2-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one
SpectraBase Compound ID DjA34DDRy5G
InChI InChI=1S/C19H15N5O4S/c1-12-21-23(14-7-9-16(28-2)10-8-14)19(25)22(12)18-20-17(11-29-18)13-3-5-15(6-4-13)24(26)27/h3-11H,1-2H3
InChIKey LSULDIRSWIZZTQ-UHFFFAOYSA-N
Mol Weight 409.42 g/mol
Molecular Formula C19H15N5O4S
Exact Mass 409.084475 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ESoNoRFk4vA
Name 2-(p-Anisyl)-5-methyl-4-[4-(p-nitrophenyl)thiazol-2-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H15N5O4S
InChI InChI=1S/C19H15N5O4S/c1-12-21-23(14-7-9-16(28-2)10-8-14)19(25)22(12)18-20-17(11-29-18)13-3-5-15(6-4-13)24(26)27/h3-11H,1-2H3
InChIKey LSULDIRSWIZZTQ-UHFFFAOYSA-N
Molecular Weight 409.420 g/mol
SMILES C1(N(C(=NN1c1ccc(cc1)OC)C)c1nc(-c2ccc(N(=O)=O)cc2)cs1)=O
SPLASH splash10-001i-0890100000-780da4ed2760faa2ba95
Source of Spectrum HC-47-882-1i
Synonyms 1-(4-Methoxyphenyl)-3-methyl-4-(4-(4-nitrophenyl)thiazol-2-yl)-1H-1,2,4-triazol-5(4H)-one 2-(4-Methoxyphenyl)-5-methyl-4-[4-(4-nitrophenyl)-2-thiazolyl]-1,2,4-triazol-3-one 2-(4-Methoxyphenyl)-5-methyl-4-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-1,2,4-triazol-3-one
Wiley ID 1734155