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N-[4-(2,5-dihydro-2,3-dimethyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)thiazol-2-yl]-N'-phenylthiourea
SpectraBase Compound ID 4fikN4Hk52K
InChI InChI=1S/C21H19N5OS2/c1-14-18(19(27)26(25(14)2)16-11-7-4-8-12-16)17-13-29-21(23-17)24-20(28)22-15-9-5-3-6-10-15/h3-13H,1-2H3,(H2,22,23,24,28)
InChIKey GQCYBVGWMPJJHX-UHFFFAOYSA-N
Mol Weight 421.54 g/mol
Molecular Formula C21H19N5OS2
Exact Mass 421.103103 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4b4ScdwS5LZ
Name N-[4-(2,5-dihydro-2,3-dimethyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)thiazol-2-yl]-N'-phenylthiourea
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19N5OS2
InChI InChI=1S/C21H19N5OS2/c1-14-18(19(27)26(25(14)2)16-11-7-4-8-12-16)17-13-29-21(23-17)24-20(28)22-15-9-5-3-6-10-15/h3-13H,1-2H3,(H2,22,23,24,28)
InChIKey GQCYBVGWMPJJHX-UHFFFAOYSA-N
Molecular Weight 421.537 g/mol
SMILES N(c1nc(C=2C(N(c3ccccc3)N(C2C)C)=O)cs1)C(Nc1ccccc1)=S
SPLASH splash10-0pp0-9330100000-ff95832f8b0dfcf898b1
Source of Spectrum EMC-70-746-2
Synonyms 1-(4-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)thiazol-2-yl)-3-phenylthiourea 1-[4-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-thiazolyl]-3-phenylthiourea 1-[4-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1,3-thiazol-2-yl]-3-phenylthiourea 1-[4-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)thiazol-2-yl]-3-phenyl-thiourea 1-[4-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1,3-thiazol-2-yl]-3-phenyl-thiourea
Wiley ID 1740141