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N-Benzoyl-N'-(3-methyl-5-isoxazolyl)thiourea

View entire compound with spectra: 1 MS (GC)

N-Benzoyl-N'-(3-methyl-5-isoxazolyl)thiourea
SpectraBase Compound ID 4HLbuM7i2x6
InChI InChI=1S/C12H11N3O2S/c1-8-7-10(17-15-8)13-12(18)14-11(16)9-5-3-2-4-6-9/h2-7H,1H3,(H2,13,14,16,18)
InChIKey KDRJZNFHLNXIMW-UHFFFAOYSA-N
Mol Weight 261.3 g/mol
Molecular Formula C12H11N3O2S
Exact Mass 261.057198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Os8o8M2RMT
Name N-Benzoyl-N'-(3-methyl-5-isoxazolyl)thiourea
CAS Registry Number 118385-15-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11N3O2S
InChI InChI=1S/C12H11N3O2S/c1-8-7-10(17-15-8)13-12(18)14-11(16)9-5-3-2-4-6-9/h2-7H,1H3,(H2,13,14,16,18)
InChIKey KDRJZNFHLNXIMW-UHFFFAOYSA-N
Molecular Weight 261.299 g/mol
SMILES N(c1onc(C)c1)C(=S)NC(c1ccccc1)=O
SPLASH splash10-0a4i-5950000000-b2ba6096cda4cc5e63ae
Source of Spectrum AD-0-2532-0
Synonyms N-[(3-methyl-1,2-oxazol-5-yl)carbamothioyl]benzamide N-[(3-methylisoxazol-5-yl)carbamothioyl]benzamide N-[(3-methylisoxazol-5-yl)thiocarbamoyl]benzamide N-[[(3-methyl-5-isoxazolyl)amino]-sulfanylidenemethyl]benzamide Thiourea, 1-benzoyl-3-(3-methyl-5-isoxazolyl)-
Wiley ID 1427797