Vitas-M small molecule compound
3-[(phenylsulfanyl)methyl]-6-(tricyclo[3.3.1.1~3,7~]dec-1-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STL300362
SMILES c1ccc(cc1)SCc1nnc2n1nc(s2)C12CC3CC(C2)CC(C1)C3
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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 C20H22N4S2 MW 382.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4S2/c1-2-4-16(5-3-1)25-12-17-21-22-19-24(17)23-18(26-19)20-9-13-6-14(10-20)8-15(7-13)11-20/h1-5,13-15H,6-12H2InChIKey
JIQNDSOYCIJHCT-UHFFFAOYSA-NSynonyms
3((phenylsulfanyl)methyl)6(tricyclo(3311~37~)dec1yl)(124)triazolo(34b)(134)thiadiazole
6(1adamantyl)3(phenylsulfanylmethyl)(124)triazolo(34b)(134)thiadiazole
C1C2CC3CC1CC(C2)(C3)C4=NN5C(=NN=C5S4)CSC6=CC=CC=C6
InChI=1SC20H22N4S2c12416(531)25121721221924(17)2318(2619)20913614(1020)815(713)1120h151315H612H2
ZINC000095471835
ZINC95471835
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