Vitas-M small molecule compound
1,1'-[sulfanediylbis(2,2,2-trichloroethane-1,1-diyl)]diazepan-2-one
Catalog ID
STL575493
SMILES O=C1CCCCCN1C(C(Cl)(Cl)Cl)SC(C(Cl)(Cl)Cl)N1CCCCCC1=O
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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 C16H22Cl6N2O2S MW 519.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22Cl6N2O2S/c17-15(18,19)13(23-9-5-1-3-7-11(23)25)27-14(16(20,21)22)24-10-6-2-4-8-12(24)26/h13-14H,1-10H2InChIKey
IFYKACTYUXFXTP-UHFFFAOYSA-NSynonyms
1(222trichloro1(222trichloro1(2oxoazepan1yl)ethyl)sulfanylethyl)azepan2one
11(sulfanediylbis(222trichloroethane11diyl))diazepan2one
145916344
InChI=1SC16H22Cl6N2O2Sc1715(1819)13(239513711(23)25)2714(16(2021)22)2410624812(24)26h1314H110H2
MFCD02646052
ZINC000022022824
ZINC000022022826
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