Vitas-M small molecule compound
8-[(3-chloro-2-hydroxypropyl)sulfanyl]-3-methyl-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK835019
SMILES C=CCn1c(SCC(CCl)O)nc2c1c(=O)[nH]c(=O)n2C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C12H15ClN4O3S MW 330.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H15ClN4O3S/c1-3-4-17-8-9(16(2)11(20)15-10(8)19)14-12(17)21-6-7(18)5-13/h3,7,18H,1,4-6H2,2H3,(H,15,19,20)InChIKey
ZBNFIXNOBUATLZ-UHFFFAOYSA-NSynonyms
332408-88-5332408885
7allyl8((3chloro2hydroxypropyl)thio)3methyl1Hpurine26(3H7H)dione
8((3chloro2hydroxypropyl)sulfanyl)3methyl7(prop2en1yl)37dihydro1Hpurine26dione
8(3CHLORO2HYDROXYPROPYL)SULFANYL3METHYL7PROP2ENYLPURINE26DIONE
8(3CHLORO2HYDROXYPROPYLTHIO)3METHYL7PROP2ENYL137TRIHYDROPURINE26DIONE
C=CCn1c(SCC(CCl)O)nc2c1c(=O)(nH)c(=O)n2C
CN1C2=C(C(=O)NC1=O)N(C(=N2)SCC(CCl)O)CC=C
InChI=1SC12H15ClN4O3Sc1341789(16(2)11(20)1510(8)19)1412(17)2167(18)513h3718H146H22H3(H151920)
MFCD00809710
ZINC000000322466
ZINC000000322470
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