Vitas-M small molecule compound
methyl 3-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonyl}-5-chlorothiophene-2-carboxylate
Catalog ID
STL162870
SMILES COC(=O)c1sc(cc1S(=O)(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2)Cl
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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 C18H19ClN2O6S2 MW 458.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19ClN2O6S2/c1-25-18(22)17-15(9-16(19)28-17)29(23,24)21-6-4-20(5-7-21)10-12-2-3-13-14(8-12)27-11-26-13/h2-3,8-9H,4-7,10-11H2,1H3InChIKey
AGRVTPFQUMXDNI-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(C=C(S1)Cl)S(=O)(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4
COC(=O)c1sc(cc1S(=O)(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2)ClCl
InChI=1SC18H19ClN2O6S2c12518(22)1715(916(19)2817)29(2324)216420(5721)1012231314(812)27112613h2389H471011H21H3
methyl3((4(13benzodioxol5ylmethyl)piperazin1yl)sulfonyl)5chlorothiophene2carboxylate
methyl3((4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)sulfonyl)5chlorothiophene2carboxylatehydrochloride
methyl3(4(13benzodioxol5ylmethyl)piperazin1yl)sulfonyl5chlorothiophene2carboxylate
MFCD15147661
ZINC000049544851
ZINC49544851
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