Vitas-M small molecule compound
6-chloro-7-{2-[4-(1,1-dioxidotetrahydrothiophen-3-yl)piperazin-1-yl]-2-oxoethoxy}-4-methyl-2H-chromen-2-one
Catalog ID
STL249623
SMILES O=C(N1CCN(CC1)C1CCS(=O)(=O)C1)COc1cc2oc(=O)cc(c2cc1Cl)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 C20H23ClN2O6S MW 454.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23ClN2O6S/c1-13-8-20(25)29-17-10-18(16(21)9-15(13)17)28-11-19(24)23-5-3-22(4-6-23)14-2-7-30(26,27)12-14/h8-10,14H,2-7,11-12H2,1H3InChIKey
ZKFKYDYVSZTZPM-UHFFFAOYSA-NSynonyms
1042855-58-21042855582
6chloro7(2(4(11dioxidotetrahydrothiophen3yl)piperazin1yl)2oxoethoxy)4methyl2Hchromen2one
6chloro7(2(4(11dioxothiolan3yl)piperazin1yl)2oxoethoxy)4methylchromen2one
CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)N3CCN(CC3)C4CCS(=O)(=O)C4
InChI=1SC20H23ClN2O6Sc113820(25)29171018(16(21)915(13)17)281119(24)235322(4623)142730(2627)1214h81014H271112H21H3
MFCD12388156
ZINC000022505798
ZINC000022505803
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