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Benzoic acid, 2-chloro-6-[[[[(4,6-dimethoxy-2-pyrimidinyl)amino]carbonyl]amino]sulfonyl]-, 2-propenyl ester

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Benzoic acid, 2-chloro-6-[[[[(4,6-dimethoxy-2-pyrimidinyl)amino]carbonyl]amino]sulfonyl]-, 2-propenyl ester
SpectraBase Compound ID 5niOVk1Whxz
InChI InChI=1S/C17H17ClN4O7S/c1-4-8-29-15(23)14-10(18)6-5-7-11(14)30(25,26)22-17(24)21-16-19-12(27-2)9-13(20-16)28-3/h4-7,9H,1,8H2,2-3H3,(H2,19,20,21,22,24)
InChIKey KKGRASNXMBLRLL-UHFFFAOYSA-N
Mol Weight 456.86 g/mol
Molecular Formula C17H17ClN4O7S
Exact Mass 456.050648 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GVzkf3vnxOO
Name Benzoic acid, 2-chloro-6-[[[[(4,6-dimethoxy-2-pyrimidinyl)amino]carbonyl]amino]sulfonyl]-, 2-propenyl ester
CAS Registry Number 120257-26-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H17ClN4O7S
InChI InChI=1S/C17H17ClN4O7S/c1-4-8-29-15(23)14-10(18)6-5-7-11(14)30(25,26)22-17(24)21-16-19-12(27-2)9-13(20-16)28-3/h4-7,9H,1,8H2,2-3H3,(H2,19,20,21,22,24)
InChIKey KKGRASNXMBLRLL-UHFFFAOYSA-N
Instrument Name Bruker AM-270
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3