Vitas-M small molecule compound
4,4'-diethyl-5,5'-bis{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H,4'H-3,3'-bi-1,2,4-triazole
Catalog ID
STK806951
SMILES CCn1c(SC/C=C/c2ccccc2)nnc1c1nnc(n1CC)SC/C=C/c1ccccc1
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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 C26H28N6S2 MW 488.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N6S2/c1-3-31-23(27-29-25(31)33-19-11-17-21-13-7-5-8-14-21)24-28-30-26(32(24)4-2)34-20-12-18-22-15-9-6-10-16-22/h5-18H,3-4,19-20H2,1-2H3/b17-11+,18-12+InChIKey
JFDWQROFGOHNQL-JYFOCSDGSA-NSynonyms
496777-67-444diethyl55bis(((2E)3phenylprop2en1yl)sulfanyl)4H4H33bi124triazole
496777674
4ETHYL3(4ETHYL5((E)3PHENYLPROP2ENYL)SULFANYL124TRIAZOL3YL)5((E)3PHENYLPROP2ENYL)SULFANYL124TRIAZOLE
5((2E)3PHENYLPROP2ENYLTHIO)3(5((2E)3PHENYLPROP2ENYLTHIO)4ETHYL(124TRIAZOL3YL))4ETHYL124TRIAZOLE
CCN1C(=NN=C1SCC=CC2=CC=CC=C2)C3=NN=C(N3CC)SCC=CC4=CC=CC=C4
CCn1c(SCC=Cc2ccccc2)nnc1c1nnc(n1CC)SCC=Cc1ccccc1
InChI=1SC26H28N6S2c133123(272925(31)3319111721137581421)24283026(32(24)42)34201218221596101622h518H341920H212H3b1711+1812+
MFCD03621384
ZINC000002694997
ZINC02694997
ZINC2694997
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