Vitas-M small molecule compound
(6Z)-6-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-5-imino-2-(phenoxymethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224698
SMILES Cc1ccc(cc1)n1c(C)cc(c1C)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)COc1ccccc1
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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/c1-16-9-11-20(12-10-16)30-17(2)13-19(18(30)3)14-22-24(27)31-26(28-25(22)32)34-23(29-31)15-33-21-7-5-4-6-8-21/h4-14,27H,15H2,1-3H3/b22-14-,27-24-InChIKey
RAVGMXNMHSLLKN-XRKKSIEBSA-NSynonyms
(6Z)6((25dimethyl1(4methylphenyl)1Hpyrrol3yl)methylidene)5imino2(phenoxymethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((25dimethyl1(ptolyl)1Hpyrrol3yl)methylene)5imino2(phenoxymethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
Cc1ccc(cc1)n1c(C)cc(c1C)C=C1C(=O)N=c2n(C1=N)nc(s2)COc1ccccc1
MFCD24857863
ZINC000033619738
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