Vitas-M small molecule compound
ethyl 4-{[(3-{[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl}-1-methyl-1H-pyrazol-4-yl)carbonyl]amino}benzoate
Catalog ID
STL132977
SMILES CCOC(=O)c1ccc(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 C26H31N5O5S MW 525.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31N5O5S/c1-5-36-26(33)20-9-11-21(12-10-20)27-24(32)22-17-29(4)28-25(22)37(34,35)31-15-13-30(14-16-31)23-8-6-7-18(2)19(23)3/h6-12,17H,5,13-16H2,1-4H3,(H,27,32)InChIKey
CIOYYGFQAPXJOC-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CN(N=C2S(=O)(=O)N3CCN(CC3)C4=CC=CC(=C4C)C)C
ethyl4(((3((4(23dimethylphenyl)piperazin1yl)sulfonyl)1methyl1Hpyrazol4yl)carbonyl)amino)benzoate
ethyl4((3(4(23dimethylphenyl)piperazin1yl)sulfonyl1methylpyrazole4carbonyl)amino)benzoate
InChI=1SC26H31N5O5Sc153626(33)2091121(121020)2724(32)221729(4)2825(22)37(3435)31151330(141631)2386718(2)19(23)3h61217H51316H214H3(H2732)
MFCD20752920
ZINC000067338156
ZINC67338156
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