Vitas-M small molecule compound
methyl 4-(1-benzyl-7-hydroxy-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-4-yl)benzoate
Catalog ID
STL316049
SMILES COC(=O)c1ccc(cc1)C1SCC(=Nc2c1cnn2Cc1ccccc1)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 C21H19N3O3S MW 393.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O3S/c1-27-21(26)16-9-7-15(8-10-16)19-17-11-22-24(12-14-5-3-2-4-6-14)20(17)23-18(25)13-28-19/h2-11,19H,12-13H2,1H3,(H,23,25)InChIKey
VFJNQDDFHNKFMF-UHFFFAOYSA-NSynonyms
1435997-57-11435997571
methyl4(1benzyl7hydroxy46dihydro1Hpyrazolo(34e)(14)thiazepin4yl)benzoate
MFCD28027599
ZINC000095477489
ZINC000095477490
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