Vitas-M small molecule compound
(6Z)-5-imino-6-{[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-phenyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224567
SMILES COc1ccc(cc1)n1c(C)cc(c1C)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)c1ccccc1
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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 C25H21N5O2S MW 455.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N5O2S/c1-15-13-18(16(2)29(15)19-9-11-20(32-3)12-10-19)14-21-22(26)30-25(27-23(21)31)33-24(28-30)17-7-5-4-6-8-17/h4-14,26H,1-3H3/b21-14-,26-22-InChIKey
BNUCCRZGYFWWCI-NLAALYTPSA-NSynonyms
849826-79-5(6Z)5imino6((1(4methoxyphenyl)25dimethyl1Hpyrrol3yl)methylidene)2phenyl56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)5imino6((1(4methoxyphenyl)25dimethyl1Hpyrrol3yl)methylene)2phenyl5H(134)thiadiazolo(32a)pyrimidin7(6H)one
849826795
COc1ccc(cc1)n1c(C)cc(c1C)C=C1C(=O)N=c2n(C1=N)nc(s2)c1ccccc1
MFCD05688191
ZINC000009309553
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