Vitas-M small molecule compound
(3-{[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl}-1-ethyl-1H-pyrazol-4-yl)[4-(prop-2-en-1-yl)piperazin-1-yl]methanone
Catalog ID
STL132779
SMILES C=CCN1CCN(CC1)C(=O)c1cn(nc1S(=O)(=O)N1CCN(CC1)c1cccc(c1)Cl)CC
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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 C23H31ClN6O3S MW 507.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H31ClN6O3S/c1-3-8-26-9-11-28(12-10-26)23(31)21-18-29(4-2)25-22(21)34(32,33)30-15-13-27(14-16-30)20-7-5-6-19(24)17-20/h3,5-7,17-18H,1,4,8-16H2,2H3InChIKey
NVKIDOFLFQUCTD-UHFFFAOYSA-NSynonyms
(3((4(3chlorophenyl)piperazin1yl)sulfonyl)1ethyl1Hpyrazol4yl)(4(prop2en1yl)piperazin1yl)methanone
(3(4(3chlorophenyl)piperazin1yl)sulfonyl1ethylpyrazol4yl)(4prop2enylpiperazin1yl)methanone
CCN1C=C(C(=N1)S(=O)(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)C(=O)N4CCN(CC4)CC=C
InChI=1SC23H31ClN6O3Sc1382691128(121026)23(31)211829(42)2522(21)34(3233)30151327(141630)2075619(24)1720h3571718H14816H22H3
MFCD20752721
ZINC000067337569
ZINC67337569
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