Vitas-M small molecule compound
3-{[4-(ethylsulfonyl)piperazin-1-yl]carbonyl}-1-methyl-1H-pyrazole-4-carboxylic acid
Catalog ID
STK400107
SMILES CCS(=O)(=O)N1CCN(CC1)C(=O)c1nn(cc1C(=O)O)C
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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/c1-3-22(20,21)16-6-4-15(5-7-16)11(17)10-9(12(18)19)8-14(2)13-10/h8H,3-7H2,1-2H3,(H,18,19)InChIKey
OTTKGXKQUYIAKU-UHFFFAOYSA-NSynonyms
1006492-51-81006492518
3((4(ethylsulfonyl)piperazin1yl)carbonyl)1methyl1Hpyrazole4carboxylicacid
3(4ethylsulfonylpiperazine1carbonyl)1methylpyrazole4carboxylicacid
CCS(=O)(=O)N1CCN(CC1)C(=O)C2=NN(C=C2C(=O)O)C
InChI=1SC12H18N4O5Sc1322(2021)166415(5716)11(17)109(12(18)19)814(2)1310h8H37H212H3(H1819)
MFCD06806881
ZINC000020319297
ZINC20319297
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