Vitas-M small molecule compound
ethyl 3-{[4-(3-methylphenyl)piperazin-1-yl]sulfonyl}-1H-pyrazole-4-carboxylate
Catalog ID
STL073061
SMILES CCOC(=O)c1c[nH]nc1S(=O)(=O)N1CCN(CC1)c1cccc(c1)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 C17H22N4O4S MW 378.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N4O4S/c1-3-25-17(22)15-12-18-19-16(15)26(23,24)21-9-7-20(8-10-21)14-6-4-5-13(2)11-14/h4-6,11-12H,3,7-10H2,1-2H3,(H,18,19)InChIKey
IVIYARYKNIWFIL-UHFFFAOYSA-NSynonyms
1260947-96-31260947963
CCOC(=O)C1=C(NN=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3)C
CCOC(=O)c1c(nH)nc1S(=O)(=O)N1CCN(CC1)c1cccc(c1)C
ethyl3((4(3methylphenyl)piperazin1yl)sulfonyl)1Hpyrazole4carboxylate
ethyl5(4(3methylphenyl)piperazin1yl)sulfonyl1Hpyrazole4carboxylate
InChI=1SC17H22N4O4Sc132517(22)1512181916(15)26(2324)219720(81021)1464513(2)1114h461112H3710H212H3(H1819)
MFCD18194696
ZINC000057478138
ZINC57478138
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