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o-{[3-(7,8-dihydro-4-methyl-5H-thiopyrano[4,3-d]pyrimidin-2-yl)ureido]sulfonyl}benzoic acid, methyl ester, S,S-dioxide
SpectraBase Compound ID 46W09Tlv6kH
InChI InChI=1S/C17H18N4O7S2/c1-10-12-9-29(24,25)8-7-13(12)19-16(18-10)20-17(23)21-30(26,27)14-6-4-3-5-11(14)15(22)28-2/h3-6H,7-9H2,1-2H3,(H2,18,19,20,21,23)
InChIKey QYBOQQGQRZWXRW-UHFFFAOYSA-N
Mol Weight 454.47 g/mol
Molecular Formula C17H18N4O7S2
Exact Mass 454.061691 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID EzjqvJ7gtYM
Name o-{[3-(7,8-DIHYDRO-4-METHYL-5H-THIOPYRANO[4,3-d]PYRIMIDIN-2-YL)UREIDO]SULFONYL}BENZOIC ACID, METHYL ESTER, S,S-DIOXIDE
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18N4O7S2
InChI InChI=1S/C17H18N4O7S2/c1-10-12-9-29(24,25)8-7-13(12)19-16(18-10)20-17(23)21-30(26,27)14-6-4-3-5-11(14)15(22)28-2/h3-6H,7-9H2,1-2H3,(H2,18,19,20,21,23)
InChIKey QYBOQQGQRZWXRW-UHFFFAOYSA-N
Melting Point 230C (dec.)
Molecular Weight 454.48
Technique KBr WAFER