Vitas-M small molecule compound
3-(4-ethylphenyl)-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocine-4-thione
Catalog ID
STL092772
SMILES CCc1ccc(cc1)N1C(=S)NC2CC1(C)Oc1c2cccc1
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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 C19H20N2OS MW 324.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2OS/c1-3-13-8-10-14(11-9-13)21-18(23)20-16-12-19(21,2)22-17-7-5-4-6-15(16)17/h4-11,16H,3,12H2,1-2H3,(H,20,23)InChIKey
FJLQBPOAOJGXIX-UHFFFAOYSA-NSynonyms
896703-95-03(4ethylphenyl)2methyl2356tetrahydro4H26methano135benzoxadiazocine4thione
896703950
CCC1=CC=C(C=C1)N2C(=S)NC3CC2(OC4=CC=CC=C34)C
InChI=1SC19H20N2OSc131381014(11913)2118(23)20161219(212)2217754615(16)17h41116H312H212H3(H2023)
MFCD15086221
ZINC000100031945
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