![N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-N-{4-hydroxy-1-methyl-2-[(2-p-toluoylethyl)thio]-1-butenyl}formamide, monohydrochloride](/api/spectrum/3YMidRpDFhv/structure.png?h=300&w=458 "N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-N-{4-hydroxy-1-methyl-2-[(2-p-toluoylethyl)thio]-1-butenyl}formamide, monohydrochloride")
| SpectraBase Compound ID | LrD8MPq4RRg |
|---|---|
| InChI | InChI=1S/C22H28N4O3S.ClH/c1-15-4-6-18(7-5-15)20(29)9-11-30-21(8-10-27)16(2)26(14-28)13-19-12-24-17(3)25-22(19)23;/h4-7,12,14,27H,8-11,13H2,1-3H3,(H2,23,24,25);1H |
| InChIKey | ZJZCTCNQTXBBFZ-UHFFFAOYSA-N |
| Mol Weight | 465.01 g/mol |
| Molecular Formula | C22H29ClN4O3S |
| Exact Mass | 464.16489 g/mol |
Ultraviolet-Visible (UV-Vis) Spectrum
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| SpectraBase Spectrum ID | 3YMidRpDFhv |
|---|---|
| Name | N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-N-{4-hydroxy-1-methyl-2-[(2-p-toluoylethyl)thio]-1-butenyl}formamide, monohydrochloride |
| Conditions | Neutral |
| Copyright | Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H29ClN4O3S |
| InChI | InChI=1S/C22H28N4O3S.ClH/c1-15-4-6-18(7-5-15)20(29)9-11-30-21(8-10-27)16(2)26(14-28)13-19-12-24-17(3)25-22(19)23;/h4-7,12,14,27H,8-11,13H2,1-3H3,(H2,23,24,25);1H |
| InChIKey | ZJZCTCNQTXBBFZ-UHFFFAOYSA-N |
| Sadtler IR Number | 37545 |
| Sadtler UV Number | 16623N |
| Solvent | Methanol |