Vitas-M small molecule compound
1-methyl-5-{[4-(phenylsulfonyl)piperazin-1-yl]carbonyl}-1H-pyrazole-4-carboxylic acid
Catalog ID
STL405347
SMILES OC(=O)c1cnn(c1C(=O)N1CCN(CC1)S(=O)(=O)c1ccccc1)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 C16H18N4O5S MW 378.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4O5S/c1-18-14(13(11-17-18)16(22)23)15(21)19-7-9-20(10-8-19)26(24,25)12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3,(H,22,23)InChIKey
GMJXJLAESVTGJZ-UHFFFAOYSA-NSynonyms
1174847-38-11174847381
1methyl5((4(phenylsulfonyl)piperazin1yl)carbonyl)1Hpyrazole4carboxylicacid
5(4(benzenesulfonyl)piperazine1carbonyl)1methylpyrazole4carboxylicacid
CN1C(=C(C=N1)C(=O)O)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3
InChI=1SC16H18N4O5Sc11814(13(111718)16(22)23)15(21)197920(10819)26(2425)125324612h2611H710H21H3(H2223)
MFCD09470081
ZINC000020602711
ZINC20602711
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