Vitas-M small molecule compound
1-({3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)azepane
Catalog ID
STL030961
SMILES CSc1ccc(cc1)c1noc(n1)CN1CCCCCC1
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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 C16H21N3OS MW 303.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N3OS/c1-21-14-8-6-13(7-9-14)16-17-15(20-18-16)12-19-10-4-2-3-5-11-19/h6-9H,2-5,10-12H2,1H3InChIKey
OWKNEWILPSPISE-UHFFFAOYSA-NSynonyms
1((3(4(methylsulfanyl)phenyl)124oxadiazol5yl)methyl)azepane
5(azepan1ylmethyl)3(4methylsulfanylphenyl)124oxadiazole
CSC1=CC=C(C=C1)C2=NOC(=N2)CN3CCCCCC3
InChI=1SC16H21N3OSc121148613(7914)161715(201816)12191042351119h69H251012H21H3
MFCD18191025
ZINC000057427624
ZINC57427624
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