Vitas-M small molecule compound
ethyl 3-{[3-methyl-4-(3-methylphenyl)piperazin-1-yl]sulfonyl}-1H-pyrazole-5-carboxylate
Catalog ID
STL104117
SMILES CCOC(=O)c1[nH]nc(c1)S(=O)(=O)N1CCN(C(C1)C)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 C18H24N4O4S MW 392.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24N4O4S/c1-4-26-18(23)16-11-17(20-19-16)27(24,25)21-8-9-22(14(3)12-21)15-7-5-6-13(2)10-15/h5-7,10-11,14H,4,8-9,12H2,1-3H3,(H,19,20)InChIKey
GUPVUGCFVRYNMI-UHFFFAOYSA-NSynonyms
CCOC(=O)c1(nH)nc(c1)S(=O)(=O)N1CCN(C(C1)C)c1cccc(c1)C
CCOC(=O)C1=NNC(=C1)S(=O)(=O)N2CCN(C(C2)C)C3=CC=CC(=C3)C
ethyl3((3methyl4(3methylphenyl)piperazin1yl)sulfonyl)1Hpyrazole5carboxylate
ethyl5(3methyl4(3methylphenyl)piperazin1yl)sulfonyl1Hpyrazole3carboxylate
InChI=1SC18H24N4O4Sc142618(23)161117(201916)27(2425)218922(14(3)1221)1575613(2)1015h57101114H48912H213H3(H1920)
MFCD15029217
ZINC000008611675
ZINC000013810619
Check stock
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Check stock on Vitas-MAvailable files
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