Vitas-M small molecule compound
4-(3-methoxyphenyl)-3-methyl-1-(9H-purin-6-yl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Catalog ID
STL287755
SMILES COc1cccc(c1)C1SCC(=O)Nc2c1c(C)nn2c1ncnc2c1nc[nH]2
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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 C19H17N7O2S MW 407.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N7O2S/c1-10-14-16(11-4-3-5-12(6-11)28-2)29-7-13(27)24-18(14)26(25-10)19-15-17(21-8-20-15)22-9-23-19/h3-6,8-9,16H,7H2,1-2H3,(H,24,27)(H,20,21,22,23)InChIKey
CLDZJTDDIPUOJA-UHFFFAOYSA-NSynonyms
1144475-01-31144475013
4(3methoxyphenyl)3methyl1(9Hpurin6yl)48dihydro1Hpyrazolo(34e)(14)thiazepin7(6H)one
4(3methoxyphenyl)3methyl1(9Hpurin6yl)68dihydro1Hpyrazolo(34e)(14)thiazepin7(4H)one
COc1cccc(c1)C1SCC(=O)Nc2c1c(C)nn2c1ncnc2c1nc(nH)2
MFCD12218445
ZINC000031812143
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