Vitas-M small molecule compound
3-(azepan-1-ylmethyl)-6-[5-(propan-2-yl)-1H-pyrazol-3-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STL145830
SMILES CC(c1[nH]nc(c1)c1nn2c(s1)nnc2CN1CCCCCC1)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 C16H23N7S MW 345.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H23N7S/c1-11(2)12-9-13(18-17-12)15-21-23-14(19-20-16(23)24-15)10-22-7-5-3-4-6-8-22/h9,11H,3-8,10H2,1-2H3,(H,17,18)InChIKey
VOWWTYLBKYBAKZ-UHFFFAOYSA-NSynonyms
1282094-72-71282094727
3(azepan1ylmethyl)6(5(propan2yl)1Hpyrazol3yl)(124)triazolo(34b)(134)thiadiazole
3(azepan1ylmethyl)6(5isopropyl1Hpyrazol3yl)(124)triazolo(34b)(134)thiadiazole
3(azepan1ylmethyl)6(5propan2yl1Hpyrazol3yl)(124)triazolo(34b)(134)thiadiazole
CC(C)C1=CC(=NN1)C2=NN3C(=NN=C3S2)CN4CCCCCC4
CC(c1(nH)nc(c1)c1nn2c(s1)nnc2CN1CCCCCC1)C
InChI=1SC16H23N7Sc111(2)12913(181712)15212314(192016(23)2415)102275346822h911H3810H212H3(H1718)
MFCD18487680
ZINC000061719409
ZINC61719409
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