Vitas-M small molecule compound

1-{2-[4-(ethylsulfonyl)piperazin-1-yl]-2-oxoethyl}-1H-pyrazole-3-carboxylic acid

Catalog ID
STK400103
SMILES CCS(=O)(=O)N1CCN(CC1)C(=O)Cn1ccc(n1)C(=O)O

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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 C12H18N4O5S MW 330.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H18N4O5S/c1-2-22(20,21)16-7-5-14(6-8-16)11(17)9-15-4-3-10(13-15)12(18)19/h3-4H,2,5-9H2,1H3,(H,18,19)
InChIKey
NKAQAEXRFOQVPZ-UHFFFAOYSA-N
Synonyms
1006444-64-9
1(2(4(ethylsulfonyl)piperazin1yl)2oxoethyl)1Hpyrazole3carboxylicacid
1(2(4ethylsulfonylpiperazin1yl)2oxoethyl)pyrazole3carboxylicacid
1006444649
CCS(=O)(=O)N1CCN(CC1)C(=O)CN2C=CC(=N2)C(=O)O
InChI=1SC12H18N4O5Sc1222(2021)167514(6816)11(17)9154310(1315)12(18)19h34H259H21H3(H1819)
MFCD06807127
ZINC000020320586
ZINC20320586

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Available files

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