Vitas-M small molecule compound
(6Z)-5-imino-6-{[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-(2-methylphenyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224702
SMILES COc1ccc(cc1)n1c(C)cc(c1C)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)c1ccccc1C
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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 C26H23N5O2S MW 469.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N5O2S/c1-15-7-5-6-8-21(15)25-29-31-23(27)22(24(32)28-26(31)34-25)14-18-13-16(2)30(17(18)3)19-9-11-20(33-4)12-10-19/h5-14,27H,1-4H3/b22-14-,27-23-InChIKey
VKCKTRLQMCRICT-WSAMZLRMSA-NSynonyms
(6Z)5imino6((1(4methoxyphenyl)25dimethyl1Hpyrrol3yl)methylidene)2(2methylphenyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)5imino6((1(4methoxyphenyl)25dimethyl1Hpyrrol3yl)methylene)2(otolyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
COc1ccc(cc1)n1c(C)cc(c1C)C=C1C(=O)N=c2n(C1=N)nc(s2)c1ccccc1C
MFCD24857867
ZINC000033920733
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