Vitas-M small molecule compound
(6E)-6-{[2,5-dimethyl-1-(2-methyl-5-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-5-imino-3-methyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK712714
SMILES O=C1N=c2scc(n2C(=N)/C/1=C\c1cc(n(c1C)c1cc(ccc1C)[N+](=O)[O-])C)C
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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 C21H19N5O3S MW 421.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N5O3S/c1-11-5-6-16(26(28)29)9-18(11)24-12(2)7-15(14(24)4)8-17-19(22)25-13(3)10-30-21(25)23-20(17)27/h5-10,22H,1-4H3/b17-8+,22-19-InChIKey
GAPFTJLFMJAZMC-VGVMCJSMSA-NSynonyms
714289-52-8(6E)6((25dimethyl1(2methyl5nitrophenyl)1Hpyrrol3yl)methylidene)5imino3methyl56dihydro7H(13)thiazolo(32a)pyrimidin7one
(E)6((25dimethyl1(2methyl5nitrophenyl)1Hpyrrol3yl)methylene)5imino3methyl5Hthiazolo(32a)pyrimidin7(6H)one
714289528
MFCD05696965
O=C1N=c2scc(n2C(=N)C1=Cc1cc(n(c1C)c1cc(ccc1C)(N+)(=O)(O))C)C
ZINC000013810924
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