Vitas-M small molecule compound
(6Z)-6-{[2,5-dimethyl-1-(2-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
STL224696
SMILES Cc1ccccc1n1c(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/c1-16-9-7-8-12-22(16)30-17(2)13-19(18(30)3)14-21-24(27)31-26(28-25(21)32)34-23(29-31)15-33-20-10-5-4-6-11-20/h4-14,27H,15H2,1-3H3/b21-14-,27-24-InChIKey
AGXNEWJWMNUNGD-QFVKKHJYSA-NSynonyms
(6Z)6((25dimethyl1(2methylphenyl)1Hpyrrol3yl)methylidene)5imino2(phenoxymethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((25dimethyl1(otolyl)1Hpyrrol3yl)methylene)5imino2(phenoxymethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
Cc1ccccc1n1c(C)cc(c1C)C=C1C(=O)N=c2n(C1=N)nc(s2)COc1ccccc1
MFCD24857861
ZINC000033743336
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