Vitas-M small molecule compound
(6Z)-5-imino-6-{[1-(2-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-methyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL145932
SMILES COc1ccccc1n1c(C)cc(c1C)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)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 C20H19N5O2S MW 393.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5O2S/c1-11-9-14(12(2)24(11)16-7-5-6-8-17(16)27-4)10-15-18(21)25-20(22-19(15)26)28-13(3)23-25/h5-10,21H,1-4H3/b15-10-,21-18-InChIKey
JHADVHIWNKIZMQ-WVPXGCSDSA-NSynonyms
(6Z)5imino6((1(2methoxyphenyl)25dimethyl1Hpyrrol3yl)methylidene)2methyl56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)5imino6((1(2methoxyphenyl)25dimethyl1Hpyrrol3yl)methylene)2methyl5H(134)thiadiazolo(32a)pyrimidin7(6H)one
COc1ccccc1n1c(C)cc(c1C)C=C1C(=O)N=c2n(C1=N)nc(s2)C
MFCD20731917
ZINC000034690181
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