Vitas-M small molecule compound
(6E)-6-{[1-(2,5-dimethoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-(furan-2-yl)-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224766
SMILES COc1ccc(cc1n1c(C)cc(c1C)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)c1ccco1)OC
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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 C24H21N5O4S MW 475.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N5O4S/c1-13-10-15(14(2)28(13)18-12-16(31-3)7-8-19(18)32-4)11-17-21(25)29-24(26-22(17)30)34-23(27-29)20-6-5-9-33-20/h5-12,25H,1-4H3/b17-11+,25-21-InChIKey
XRTACTYMNKEZAX-UNGVNWCMSA-NSynonyms
862488-62-8(6E)6((1(25dimethoxyphenyl)25dimethyl1Hpyrrol3yl)methylidene)2(furan2yl)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(25dimethoxyphenyl)25dimethyl1Hpyrrol3yl)methylene)2(furan2yl)5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
862488628
COc1ccc(cc1n1c(C)cc(c1C)C=C1C(=O)N=c2n(C1=N)nc(s2)c1ccco1)OC
MFCD05699278
ZINC000009293271
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