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Urea, 1-(4-isopropylsulfonyl-3-chloro-2-thienyl)-3-(2-nitrophenyl)-
SpectraBase Compound ID yiXOrDZVSY
InChI InChI=1S/C14H14ClN3O5S2/c1-8(2)25(22,23)11-7-24-13(12(11)15)17-14(19)16-9-5-3-4-6-10(9)18(20)21/h3-8H,1-2H3,(H2,16,17,19)
InChIKey WEASOPKFOBVWBS-UHFFFAOYSA-N
Mol Weight 403.86 g/mol
Molecular Formula C14H14ClN3O5S2
Exact Mass 403.006341 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3cowaUCgSG
Name Urea, 1-(4-isopropylsulfonyl-3-chloro-2-thienyl)-3-(2-nitrophenyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14ClN3O5S2
InChI InChI=1S/C14H14ClN3O5S2/c1-8(2)25(22,23)11-7-24-13(12(11)15)17-14(19)16-9-5-3-4-6-10(9)18(20)21/h3-8H,1-2H3,(H2,16,17,19)
InChIKey WEASOPKFOBVWBS-UHFFFAOYSA-N
Molecular Weight 403.855 g/mol
SMILES N(c1c(c(S(=O)(=O)C(C)C)cs1)Cl)C(Nc1c(N(=O)=O)cccc1)=O
SPLASH splash10-000f-9410000000-e82d201bdb2b11e9b930
Source of Spectrum AD-0-2532-0
Synonyms 1-(3-Chloranyl-4-propan-2-ylsulfonyl-thiophen-2-yl)-3-(2-nitrophenyl)urea 1-(3-Chloro-4-isopropylsulfonyl-2-thienyl)-3-(2-nitrophenyl)urea 1-(3-Chloro-4-propan-2-ylsulfonyl-2-thiophenyl)-3-(2-nitrophenyl)urea 1-(3-Chloro-4-propan-2-ylsulfonylthiophen-2-yl)-3-(2-nitrophenyl)urea N-[3-Chloro-4-(isopropylsulfonyl)-2-thienyl]-N'-(2-nitrophenyl)urea
Wiley ID 1429027