Vitas-M small molecule compound
(1'S,2'S,5'R)-2,2'-[ethane-1,2-diylbis(5-thioxo-1H-tetrazole-4,1(5H)-diyl)]bis(6,8-dioxabicyclo[3.2.1]octan-4-one) (non-preferred name)
Catalog ID
STK681980
SMILES O=C1CC(C2OC1OC2)n1nnn(c1=S)CCn1nnn(c1=S)[C@H]1CC(=O)[C@H]2O[C@@H]1CO2
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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 C16H18N8O6S2 MW 482.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N8O6S2/c25-9-3-7(11-5-27-13(9)29-11)23-15(31)21(17-19-23)1-2-22-16(32)24(20-18-22)8-4-10(26)14-28-6-12(8)30-14/h7-8,11-14H,1-6H2/t7-,8?,11+,12?,13+,14?/m0/s1InChIKey
TVNXNJLMGVNNBY-UWPHGPRCSA-NSynonyms
(1S2S5R)22(ethane12diylbis(5thioxo1Htetrazole41(5H)diyl))bis(68dioxabicyclo(321)octan4one)(nonpreferredname)
2(4(2(4((1S2S5R)4oxo68dioxabicyclo(321)octan2yl)5sulfanylidenetetrazol1yl)ethyl)5sulfanylidenetetrazol1yl)68dioxabicyclo(321)octan4one
C1C(C2COC(C1=O)O2)N3C(=S)N(N=N3)CCN4C(=S)N(N=N4)C5CC(=O)C6OCC5O6
InChI=1SC16H18N8O6S2c25937(1152713(9)2911)2315(31)21(171923)122216(32)24(201822)8410(26)1428612(8)3014h781114H16H2t78?11+12?13+14?m0s1
O=C1CC(C2OC1OC2)n1nnn(c1=S)CCn1nnn(c1=S)(C@H)1CC(=O)(C@H)2O(C@@H)1CO2
ZINC000105899129
ZINC000105899132
Check stock
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