Vitas-M small molecule compound
3-(azepan-1-ylmethyl)-6-(3-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STL086133
SMILES Cc1cccc(c1)c1nn2c(s1)nnc2CN1CCCCCC1
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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 C17H21N5S MW 327.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N5S/c1-13-7-6-8-14(11-13)16-20-22-15(18-19-17(22)23-16)12-21-9-4-2-3-5-10-21/h6-8,11H,2-5,9-10,12H2,1H3InChIKey
SUMHGEVPBRCVLS-UHFFFAOYSA-NSynonyms
3(1AZEPANYLMETHYL)6(3METHYLPHENYL)(124)TRIAZOLO(34B)(134)THIADIAZOLE
3(azepan1ylmethyl)6(3methylphenyl)(124)triazolo(34b)(134)thiadiazole
CC1=CC=CC(=C1)C2=NN3C(=NN=C3S2)CN4CCCCCC4
InChI=1SC17H21N5Sc11376814(1113)16202215(181917(22)2316)1221942351021h6811H2591012H21H3
MFCD18203596
ZINC000057524540
ZINC57524540
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