Vitas-M small molecule compound

2-methyl-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]quinoline

Catalog ID
STL221406
SMILES Cc1nc2ccccc2c(c1)c1nn2c(s1)nnc2C12CC3CC(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 C23H23N5S MW 401.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N5S/c1-13-6-18(17-4-2-3-5-19(17)24-13)20-27-28-21(25-26-22(28)29-20)23-10-14-7-15(11-23)9-16(8-14)12-23/h2-6,14-16H,7-12H2,1H3
InChIKey
PFWOQXOMKDFCNK-UHFFFAOYSA-N
Synonyms

2methyl4(3(tricyclo(3311~37~)dec1yl)(124)triazolo(34b)(134)thiadiazol6yl)quinoline
3(1adamantyl)6(2methylquinolin4yl)(124)triazolo(34b)(134)thiadiazole
CC1=NC2=CC=CC=C2C(=C1)C3=NN4C(=NN=C4S3)C56CC7CC(C5)CC(C7)C6
InChI=1SC23H23N5Sc113618(17423519(17)2413)20272821(252622(28)2920)231014715(1123)916(814)1223h261416H712H21H3
ZINC000080346351
ZINC80346351

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Available files

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