Vitas-M small molecule compound
(2E)-2-[(1R,2R,5S)-2-(5-phenyl-1H-tetrazol-1-yl)-6,8-dioxabicyclo[3.2.1]oct-4-ylidene]hydrazinecarbothioamide (non-preferred name)
Catalog ID
STK682270
SMILES NC(=S)N/N=C/1\C[C@H]([C@H]2O[C@@H]1OC2)n1nnnc1c1ccccc1
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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 C14H15N7O2S MW 345.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15N7O2S/c15-14(24)18-16-9-6-10(11-7-22-13(9)23-11)21-12(17-19-20-21)8-4-2-1-3-5-8/h1-5,10-11,13H,6-7H2,(H3,15,18,24)/b16-9+/t10-,11+,13+/m1/s1InChIKey
VADMSKYWFQXCTI-VETDHQSRSA-NSynonyms
((E)((1R2R5S)2(5phenyltetrazol1yl)68dioxabicyclo(321)octan4ylidene)amino)thiourea(2E)2((1R2R5S)2(5phenyl1Htetrazol1yl)68dioxabicyclo(321)oct4ylidene)hydrazinecarbothioamide(nonpreferredname)
C1C(C2COC(C1=NNC(=S)N)O2)N3C(=NN=N3)C4=CC=CC=C4
NC(=S)NN=C1C(C@H)((C@H)2O(C@@H)1OC2)n1nnnc1c1ccccc1
Registry IDs
MFCD18246890ZINC000004601629
ZINC5648002
Check stock
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Check stock on Vitas-MAvailable files
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