Vitas-M small molecule compound
4-{(E)-[5-imino-7-oxo-2-(pyridin-3-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}phenyl methanesulfonate
Catalog ID
STL233899
SMILES O=C1N=c2sc(nn2C(=N)/C/1=C\c1ccc(cc1)OS(=O)(=O)C)c1cccnc1
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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 C18H13N5O4S2 MW 427.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13N5O4S2/c1-29(25,26)27-13-6-4-11(5-7-13)9-14-15(19)23-18(21-16(14)24)28-17(22-23)12-3-2-8-20-10-12/h2-10,19H,1H3/b14-9+,19-15-InChIKey
SEKHTFNFTZJYEN-DTWMHPQNSA-NSynonyms
844823-11-6(E)4((5imino7oxo2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)phenylmethanesulfonate
4((E)(5imino7oxo2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)phenylmethanesulfonate
844823116
MFCD04160614
O=C1N=c2sc(nn2C(=N)C1=Cc1ccc(cc1)OS(=O)(=O)C)c1cccnc1
ZINC000006144812
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