Vitas-M small molecule compound
4-(4-hydroxy-3-methoxyphenyl)-3-methyl-1-(9H-purin-6-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Catalog ID
STK655184
SMILES COc1cc(ccc1O)C1SCC(=Nc2c1c(C)nn2c1ncnc2c1nc[nH]2)O
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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 C19H17N7O3S MW 423.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N7O3S/c1-9-14-16(10-3-4-11(27)12(5-10)29-2)30-6-13(28)24-18(14)26(25-9)19-15-17(21-7-20-15)22-8-23-19/h3-5,7-8,16,27H,6H2,1-2H3,(H,24,28)(H,20,21,22,23)InChIKey
KPBXEYPRONFEFK-UHFFFAOYSA-NSynonyms
1144434-29-61144434296
4(4hydroxy3methoxyphenyl)3methyl1(9Hpurin6yl)46dihydro1Hpyrazolo(34e)(14)thiazepin7ol
COc1cc(ccc1O)C1SCC(=Nc2c1c(C)nn2c1ncnc2c1nc(nH)2)O
MFCD18167272
ZINC000031809732
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