Vitas-M small molecule compound

3-(1,3-benzodioxol-5-yl)-5-(5-methylfuran-2-yl)-1-(methylsulfonyl)-4,5-dihydro-1H-pyrazole

Catalog ID
STK953348
SMILES Cc1ccc(o1)C1CC(=NN1S(=O)(=O)C)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 C16H16N2O5S MW 348.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O5S/c1-10-3-5-14(23-10)13-8-12(17-18(13)24(2,19)20)11-4-6-15-16(7-11)22-9-21-15/h3-7,13H,8-9H2,1-2H3
InChIKey
MLIYAYVWQUFEKZ-UHFFFAOYSA-N
Synonyms
949876-66-8
3(13benzodioxol5yl)5(5methylfuran2yl)1(methylsulfonyl)45dihydro1Hpyrazole
3(BENZO(D)(13)DIOXOL5YL)5(5METHYLFURAN2YL)1(METHYLSULFONYL)45DIHYDRO1HPYRAZOLE
5(13benzodioxol5yl)3(5methylfuran2yl)2methylsulfonyl34dihydropyrazole
949876668
CC1=CC=C(O1)C2CC(=NN2S(=O)(=O)C)C3=CC4=C(C=C3)OCO4
InChI=1SC16H16N2O5Sc1103514(2310)13812(1718(13)24(219)20)11461516(711)2292115h3713H89H212H3
MFCD09983475
ZINC000011692682
ZINC000011692683

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Available files

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