Vitas-M small molecule compound
N,N-dimethyl-4-[3-(tricyclo[3.3.1.1~3,7~]dec-1-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]aniline
Catalog ID
STL221380
SMILES CN(c1ccc(cc1)c1sc2n(n1)c(nn2)C12CC3CC(C2)CC(C1)C3)C
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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 C21H25N5S MW 379.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5S/c1-25(2)17-5-3-16(4-6-17)18-24-26-19(22-23-20(26)27-18)21-10-13-7-14(11-21)9-15(8-13)12-21/h3-6,13-15H,7-12H2,1-2H3InChIKey
HEWPUTLJRFDGGY-UHFFFAOYSA-NSynonyms
4(3(1adamantyl)(124)triazolo(34b)(134)thiadiazol6yl)NNdimethylaniline
CN(C)C1=CC=C(C=C1)C2=NN3C(=NN=C3S2)C45CC6CC(C4)CC(C6)C5
InChI=1SC21H25N5Sc125(2)175316(4617)18242619(222320(26)2718)211013714(1121)915(813)1221h361315H712H212H3
NNdimethyl4(3(tricyclo(3311~37~)dec1yl)(124)triazolo(34b)(134)thiadiazol6yl)aniline
ZINC000080346247
ZINC80346247
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