Vitas-M small molecule compound
dimethyl 3,3'-(1,4-diazepane-1,4-diyldisulfonyl)bis(6-chlorobenzoate)
Catalog ID
STK762825
SMILES COC(=O)c1cc(ccc1Cl)S(=O)(=O)N1CCCN(CC1)S(=O)(=O)c1ccc(c(c1)C(=O)OC)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 C21H22Cl2N2O8S2 MW 565.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22Cl2N2O8S2/c1-32-20(26)16-12-14(4-6-18(16)22)34(28,29)24-8-3-9-25(11-10-24)35(30,31)15-5-7-19(23)17(13-15)21(27)33-2/h4-7,12-13H,3,8-11H2,1-2H3InChIKey
NAJUUFXHASHPTG-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)OC)Cl
DIMETHYL33(14DIAZEPANE14DIYLDISULFONYL)BIS(6CHLOROBENZOATE)
InChI=1SC21H22Cl2N2O8S2c13220(26)161214(4618(16)22)34(2829)2483925(111024)35(3031)155719(23)17(1315)21(27)332h471213H3811H212H3
METHYL2CHLORO5((4((4CHLORO3(METHOXYCARBONYL)PHENYL)SULFONYL)(14DIAZAPERHYDROEPINYL))SULFONYL)BENZOATE
METHYL2CHLORO5((4(4CHLORO3METHOXYCARBONYLPHENYL)SULFONYL14DIAZEPAN1YL)SULFONYL)BENZOATE
MFCD02110624
ZINC000001097716
ZINC1097716
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