Vitas-M small molecule compound
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium
Catalog ID
STL327278
SMILES c1ccc(cc1)[n+]1c(cn2c1SCCC2)c1ccc2c(c1)OCCO2
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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 C20H19N2O2S MW 351.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N2O2S/c1-2-5-16(6-3-1)22-17(14-21-9-4-12-25-20(21)22)15-7-8-18-19(13-15)24-11-10-23-18/h1-3,5-8,13-14H,4,9-12H2/q+1InChIKey
GCHWDZUCZPEDNJ-UHFFFAOYSA-NSynonyms
2(23dihydro14benzodioxin6yl)1phenyl67dihydro5Himidazo(21b)(13)thiazin1ium
2(23DIHYDRO14BENZODIOXIN6YL)1PHENYL67DIHYDRO5HIMIDAZO(21B)(13)THIAZIN4IUM
C1C(N+)2=C(N(C(=C2)C3=CC4=C(C=C3)OCCO4)C5=CC=CC=C5)SC1
c1ccc(cc1)(n+)1c(cn2c1SCCC2)c1ccc2c(c1)OCCO2
InChI=1SC20H19N2O2Sc12516(631)2217(142194122520(21)22)15781819(1315)2411102318h13581314H4912H2q+1
MFCD01942615
ZINC000012559961
ZINC12559961
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