Vitas-M small molecule compound

ethyl 5-(3,4-dihydroquinolin-1(2H)-ylsulfonyl)-1H-pyrazole-4-carboxylate

Catalog ID
STL104170
SMILES CCOC(=O)c1cn[nH]c1S(=O)(=O)N1CCCc2c1cccc2

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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 C15H17N3O4S MW 335.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17N3O4S/c1-2-22-15(19)12-10-16-17-14(12)23(20,21)18-9-5-7-11-6-3-4-8-13(11)18/h3-4,6,8,10H,2,5,7,9H2,1H3,(H,16,17)
InChIKey
ZHFSPVCPZVFFEJ-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(NN=C1)S(=O)(=O)N2CCCC3=CC=CC=C32
CCOC(=O)c1cn(nH)c1S(=O)(=O)N1CCCc2c1cccc2
ethyl5(34dihydro2Hquinolin1ylsulfonyl)1Hpyrazole4carboxylate
ethyl5(34dihydroquinolin1(2H)ylsulfonyl)1Hpyrazole4carboxylate
InChI=1SC15H17N3O4Sc122215(19)1210161714(12)23(2021)1895711634813(11)18h346810H2579H21H3(H1617)
MFCD17911479
ZINC000021883855
ZINC21883855

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.