Vitas-M small molecule compound
methyl 4-[7-hydroxy-3-methyl-1-(pyridin-2-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-4-yl]benzoate
Catalog ID
STL309144
SMILES COC(=O)c1ccc(cc1)C1SCC(=Nc2c1c(C)nn2c1ccccn1)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 C20H18N4O3S MW 394.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O3S/c1-12-17-18(13-6-8-14(9-7-13)20(26)27-2)28-11-16(25)22-19(17)24(23-12)15-5-3-4-10-21-15/h3-10,18H,11H2,1-2H3,(H,22,25)InChIKey
IKWUTZADATUJLS-UHFFFAOYSA-NSynonyms
1401588-52-01401588520
methyl4(7hydroxy3methyl1(pyridin2yl)46dihydro1Hpyrazolo(34e)(14)thiazepin4yl)benzoate
MFCD28028757
ZINC000079495429
ZINC000079495431
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