Vitas-M small molecule compound
3-{[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl}-N-(4-ethoxyphenyl)-1-methyl-1H-pyrazole-4-carboxamide
Catalog ID
STL132965
SMILES CCOc1ccc(cc1)NC(=O)c1cn(nc1S(=O)(=O)N1CCN(CC1)c1cccc(c1C)C)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 C25H31N5O4S MW 497.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N5O4S/c1-5-34-21-11-9-20(10-12-21)26-24(31)22-17-28(4)27-25(22)35(32,33)30-15-13-29(14-16-30)23-8-6-7-18(2)19(23)3/h6-12,17H,5,13-16H2,1-4H3,(H,26,31)InChIKey
CASXBFOGKRBBLU-UHFFFAOYSA-NSynonyms
3((4(23dimethylphenyl)piperazin1yl)sulfonyl)N(4ethoxyphenyl)1methyl1Hpyrazole4carboxamide
3(4(23dimethylphenyl)piperazin1yl)sulfonylN(4ethoxyphenyl)1methylpyrazole4carboxamide
CCOC1=CC=C(C=C1)NC(=O)C2=CN(N=C2S(=O)(=O)N3CCN(CC3)C4=CC=CC(=C4C)C)C
InChI=1SC25H31N5O4Sc15342111920(101221)2624(31)221728(4)2725(22)35(3233)30151329(141630)2386718(2)19(23)3h61217H51316H214H3(H2631)
MFCD20752908
ZINC000067338119
ZINC67338119
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