Vitas-M small molecule compound
2-(benzylsulfanyl)-3-[(E)-(hydroxyimino)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK821973
SMILES O/N=C/c1c(SCc2ccccc2)nc2n(c1=O)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 C16H13N3O2S MW 311.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N3O2S/c20-16-13(10-17-21)15(18-14-8-4-5-9-19(14)16)22-11-12-6-2-1-3-7-12/h1-10,21H,11H2/b17-10+InChIKey
VHWJOKYPUMKXND-LICLKQGHSA-NSynonyms
2(benzylsulfanyl)3((E)(hydroxyimino)methyl)4Hpyrido(12a)pyrimidin4one
2BENZYLSULFANYL3((E)HYDROXYIMINOMETHYL)PYRIDO(12A)PYRIMIDIN4ONE
3((HYDROXYIMINO)METHYL)2(PHENYLMETHYLTHIO)5HYDROPYRIDINO(12A)PYRIMIDIN4ONE
C1=CC=C(C=C1)CSC2=C(C(=O)N3C=CC=CC3=N2)C=NO
InChI=1SC16H13N3O2Sc201613(101721)15(1814845919(14)16)2211126213712h11021H11H2b1710+
MFCD00858209
ON=Cc1c(SCc2ccccc2)nc2n(c1=O)cccc2
ZINC000000307326
ZINC102855816
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