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(Z)-Methyl 2-[(Z)-3-benzyl-2-(3-methyl-1H-pyrazol-5-yl-imino)-4-oxothiazolidin-5-ylidene]acetate
SpectraBase Compound ID LnTMaYaK2rD
InChI InChI=1S/C17H16N4O3S/c1-11-8-14(20-19-11)18-17-21(10-12-6-4-3-5-7-12)16(23)13(25-17)9-15(22)24-2/h3-9H,10H2,1-2H3,(H,19,20)/b13-9-,18-17-
InChIKey NYLVHKNCTSMQGB-LTVWWZOSSA-N
Mol Weight 356.4 g/mol
Molecular Formula C17H16N4O3S
Exact Mass 356.094312 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1esp8GiK1NJ
Name (Z)-Methyl 2-[(Z)-3-benzyl-2-(3-methyl-1H-pyrazol-5-yl-imino)-4-oxothiazolidin-5-ylidene]acetate
Alternate Name(s) (Z)-methyl 2-((Z)-3-benzyl-2-((3-methyl-1H-pyrazol-5-yl)imino)-4-oxothiazolidin-5-ylidene)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16N4O3S
InChI InChI=1S/C17H16N4O3S/c1-11-8-14(20-19-11)18-17-21(10-12-6-4-3-5-7-12)16(23)13(25-17)9-15(22)24-2/h3-9H,10H2,1-2H3,(H,19,20)/b13-9-,18-17-
InChIKey NYLVHKNCTSMQGB-LTVWWZOSSA-N
Molecular Weight 356.400 g/mol
SMILES [nH]1c(cc(n1)C)\N=C\1N(C(\C(=C\C(=O)OC)S1)=O)Cc1ccccc1
SPLASH splash10-0a59-9245000000-e81590357b3d2636cc80
Source of Spectrum Y-49-1385-7b
Wiley ID 1736628