Vitas-M small molecule compound
(6Z)-5-imino-6-{[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-(phenoxymethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224842
SMILES COc1ccc(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 C26H23N5O3S MW 485.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N5O3S/c1-16-13-18(17(2)30(16)19-9-11-20(33-3)12-10-19)14-22-24(27)31-26(28-25(22)32)35-23(29-31)15-34-21-7-5-4-6-8-21/h4-14,27H,15H2,1-3H3/b22-14-,27-24-InChIKey
BKASCLKUPRNZSM-XRKKSIEBSA-NSynonyms
861116-39-4(6Z)5imino6((1(4methoxyphenyl)25dimethyl1Hpyrrol3yl)methylidene)2(phenoxymethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)5imino6((1(4methoxyphenyl)25dimethyl1Hpyrrol3yl)methylene)2(phenoxymethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
861116394
COc1ccc(cc1)n1c(C)cc(c1C)C=C1C(=O)N=c2n(C1=N)nc(s2)COc1ccccc1
MFCD05682899
ZINC000009307506
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