Vitas-M small molecule compound

5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(1-hydroxy-3-methylbutan-2-yl)-1H-pyrazole-4-carboxamide

Catalog ID
STL422885
SMILES OCC(C(C)C)NC(=O)c1cn[nH]c1c1ccc2c(c1)OCCO2

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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 C17H21N3O4 MW 331.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N3O4/c1-10(2)13(9-21)19-17(22)12-8-18-20-16(12)11-3-4-14-15(7-11)24-6-5-23-14/h3-4,7-8,10,13,21H,5-6,9H2,1-2H3,(H,18,20)(H,19,22)
InChIKey
DOSWJNOSKQCCCR-UHFFFAOYSA-N
Synonyms

(S)3(23dihydrobenzo(b)(14)dioxin6yl)N(1hydroxy3methylbutan2yl)1Hpyrazole4carboxamide
5(23dihydro14benzodioxin6yl)N(1hydroxy3methylbutan2yl)1Hpyrazole4carboxamide
CC(C)C(CO)NC(=O)C1=C(NN=C1)C2=CC3=C(C=C2)OCCO3
InChI=1SC17H21N3O4c110(2)13(921)1917(22)128182016(12)11341415(711)24652314h3478101321H569H212H3(H1820)(H1922)
MFCD30708421
OC(C@H)(C(C)C)NC(=O)c1c(nH)nc1c1ccc2c(c1)OCCO2
OCC(C(C)C)NC(=O)c1cn(nH)c1c1ccc2c(c1)OCCO2
ZINC000218384201
ZINC000230215967

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Available files

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