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(trans)-5-methyl-3-(3-(4-methylpiperazin-1-yl)-1H-1,2,4-triazol-5-yl)-2-p-tolylthiazolidin-4-one
SpectraBase Compound ID JPqVuLwU1SR
InChI InChI=1S/C18H24N6OS/c1-12-4-6-14(7-5-12)16-24(15(25)13(2)26-16)18-19-17(20-21-18)23-10-8-22(3)9-11-23/h4-7,13,16H,8-11H2,1-3H3,(H,19,20,21)/t13-,16-/m1/s1
InChIKey NJBBYQUPDJGYSV-CZUORRHYSA-N
Mol Weight 372.49 g/mol
Molecular Formula C18H24N6OS
Exact Mass 372.173231 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8lnA0YJKv8S
Name (trans)-5-methyl-3-(3-(4-methylpiperazin-1-yl)-1H-1,2,4-triazol-5-yl)-2-p-tolylthiazolidin-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24N6OS
InChI InChI=1S/C18H24N6OS/c1-12-4-6-14(7-5-12)16-24(15(25)13(2)26-16)18-19-17(20-21-18)23-10-8-22(3)9-11-23/h4-7,13,16H,8-11H2,1-3H3,(H,19,20,21)/t13-,16-/m1/s1
InChIKey NJBBYQUPDJGYSV-CZUORRHYSA-N
Literature Reference DOI 10.1002/ardp.201100001
Molecular Weight 372.491 g/mol
SMILES [nH]1c(nc(n1)N1CCN(CC1)C)N1[C@@](c2ccc(cc2)C)(S[C@@](C1=O)(C)[H])[H]
SPLASH splash10-0fk9-6029000000-72c16ef0a55ea70e54d0
Source of Spectrum APC-344-828-1n
Synonyms (2R,5R)-5-methyl-3-(3-(4-methylpiperazin-1-yl)-1H-1,2,4-triazol-5-yl)-2-(p-tolyl)thiazolidin-4-one
Wiley ID 1769183