Vitas-M small molecule compound
2-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-12-phenyl-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-3-ium-9-olate
Catalog ID
STL055139
SMILES [O-]c1ccc2c(c1)Oc1c(C2c2ccccc2)c2nc([nH+]n2cn1)CSc1nc2c(s1)cccc2
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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 C26H17N5O2S2 MW 495.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H17N5O2S2/c32-16-10-11-17-19(12-16)33-25-23(22(17)15-6-2-1-3-7-15)24-29-21(30-31(24)14-27-25)13-34-26-28-18-8-4-5-9-20(18)35-26/h1-12,14,22,32H,13H2InChIKey
AWJTYNLLUQDJEH-UHFFFAOYSA-NSynonyms
847182-42-7(O)c1ccc2c(c1)Oc1c(C2c2ccccc2)c2nc((nH+)n2cn1)CSc1nc2c(s1)cccc2
2((13benzothiazol2ylsulfanyl)methyl)12phenyl12Hchromeno(32e)(124)triazolo(15c)pyrimidin3ium9olate
847182427
MFCD04184448
ZINC000009360529
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