Vitas-M small molecule compound
2-hydroxy-4-[(E)-{5-iminio-7-oxo-2-[2-oxo-2-(piperidin-1-yl)ethyl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene}methyl]phenolate
Catalog ID
STL055395
SMILES O=C(N1CCCCC1)Cc1nn2c(=NC(=O)/C(=C/c3ccc(c(c3)O)[O-])/C2=[NH2+])s1
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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 C19H19N5O4S MW 413.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N5O4S/c20-17-12(8-11-4-5-13(25)14(26)9-11)18(28)21-19-24(17)22-15(29-19)10-16(27)23-6-2-1-3-7-23/h4-5,8-9,20,25-26H,1-3,6-7,10H2/b12-8+,20-17?InChIKey
MQSUYHGAVXQXMY-CJPOYQPDSA-NSynonyms
2hydroxy4((E)(5iminio7oxo2(2oxo2(piperidin1yl)ethyl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)phenolate
MFCD04181057
O=C(N1CCCCC1)Cc1nn2c(=NC(=O)C(=Cc3ccc(c(c3)O)(O))C2=(NH2+))s1
ZINC000005163124
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