Vitas-M small molecule compound
4-(1-cyclopentyl-7-hydroxy-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-4-yl)benzoic acid
Catalog ID
STL251450
SMILES OC1=Nc2c(C(SC1)c1ccc(cc1)C(=O)O)cnn2C1CCCC1
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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 C18H19N3O3S MW 357.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O3S/c22-15-10-25-16(11-5-7-12(8-6-11)18(23)24)14-9-19-21(17(14)20-15)13-3-1-2-4-13/h5-9,13,16H,1-4,10H2,(H,20,22)(H,23,24)InChIKey
XWMQTXLLZCOKDB-UHFFFAOYSA-NSynonyms
1401587-59-41401587594
4(1cyclopentyl7hydroxy46dihydro1Hpyrazolo(34e)(14)thiazepin4yl)benzoicacid
MFCD24852663
ZINC000079493650
ZINC000079493653
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