Vitas-M small molecule compound
(6E)-5-imino-6-{[1-(3-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-(pyridin-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL239068
SMILES COc1cccc(c1)n1c(C)cc(c1C)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)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 C24H20N6O2S MW 456.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N6O2S/c1-14-10-17(15(2)29(14)18-7-4-8-19(12-18)32-3)11-20-21(25)30-24(27-22(20)31)33-23(28-30)16-6-5-9-26-13-16/h4-13,25H,1-3H3/b20-11+,25-21-InChIKey
JCQWHJZEKWHFNY-QMYOTMNLSA-NSynonyms
848928-66-5(6E)5imino6((1(3methoxyphenyl)25dimethyl1Hpyrrol3yl)methylidene)2(pyridin3yl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)5imino6((1(3methoxyphenyl)25dimethyl1Hpyrrol3yl)methylene)2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
848928665
COc1cccc(c1)n1c(C)cc(c1C)C=C1C(=O)N=c2n(C1=N)nc(s2)c1cccnc1
MFCD05677994
ZINC000009232757
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