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Benzoic acid, 2-[[[[[4-(4-cyanophenoxy)-6-methyl-2-pyrimidinyl]amino]carbonyl]amino]sulfonyl]-, methyl ester
SpectraBase Compound ID D0ccsxP91DG
InChI InChI=1S/C21H17N5O6S/c1-13-11-18(32-15-9-7-14(12-22)8-10-15)24-20(23-13)25-21(28)26-33(29,30)17-6-4-3-5-16(17)19(27)31-2/h3-11H,1-2H3,(H2,23,24,25,26,28)
InChIKey PBESHBAMYRODEI-UHFFFAOYSA-N
Mol Weight 467.46 g/mol
Molecular Formula C21H17N5O6S
Exact Mass 467.089954 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID KFfHAfc07bI
Name Benzoic acid, 2-[[[[[4-(4-cyanophenoxy)-6-methyl-2-pyrimidinyl]amino]carbonyl]amino]sulfonyl]-, methyl ester
CAS Registry Number 130019-98-6
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H17N5O6S
InChI InChI=1S/C21H17N5O6S/c1-13-11-18(32-15-9-7-14(12-22)8-10-15)24-20(23-13)25-21(28)26-33(29,30)17-6-4-3-5-16(17)19(27)31-2/h3-11H,1-2H3,(H2,23,24,25,26,28)
InChIKey PBESHBAMYRODEI-UHFFFAOYSA-N
Instrument Name Bruker IFS 88 C
Technique KBr-Pellet