Vitas-M small molecule compound
4-(1,3-benzodioxol-5-yl)-1-cyclopentyl-3-hydroxy-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Catalog ID
STK843233
SMILES O=C1CSC(c2c(N1)n(nc2O)C1CCCC1)c1ccc2c(c1)OCO2
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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 C18H19N3O4S MW 373.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O4S/c22-14-8-26-16(10-5-6-12-13(7-10)25-9-24-12)15-17(19-14)21(20-18(15)23)11-3-1-2-4-11/h5-7,11,16H,1-4,8-9H2,(H,19,22)(H,20,23)InChIKey
GIARQDSLRGEWAP-UHFFFAOYSA-NSynonyms
692264-94-14(13benzodioxol5yl)1cyclopentyl3hydroxy48dihydro1Hpyrazolo(34e)(14)thiazepin7(6H)one
4(13BENZODIOXOL5YL)1CYCLOPENTYL48DIHYDRO2HPYRAZOLO(34E)(14)THIAZEPINE37DIONE
4(benzo(d)(13)dioxol5yl)1cyclopentyl3hydroxy68dihydro1Hpyrazolo(34e)(14)thiazepin7(4H)one
692264941
C1CCC(C1)N2C3=C(C(SCC(=O)N3)C4=CC5=C(C=C4)OCO5)C(=O)N2
InChI=1SC18H19N3O4Sc221482616(10561213(710)2592412)1517(1914)21(2018(15)23)11312411h571116H1489H2(H1922)(H2023)
MFCD03665715
ZINC000004918385
ZINC000005649701
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