Vitas-M small molecule compound
(6Z)-6-{3-chloro-4-[2-(2-ethylphenoxy)ethoxy]benzylidene}-5-imino-2-(pyridin-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL240135
SMILES CCc1ccccc1OCCOc1ccc(cc1Cl)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)c1cccnc1
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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 C27H22ClN5O3S MW 532.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22ClN5O3S/c1-2-18-6-3-4-8-22(18)35-12-13-36-23-10-9-17(15-21(23)28)14-20-24(29)33-27(31-25(20)34)37-26(32-33)19-7-5-11-30-16-19/h3-11,14-16,29H,2,12-13H2,1H3/b20-14-,29-24-InChIKey
UHLNRVSEPMZHPJ-TYPXUYNKSA-NSynonyms
844463-82-7(6Z)6(3chloro4(2(2ethylphenoxy)ethoxy)benzylidene)5imino2(pyridin3yl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)6(3chloro4(2(2ethylphenoxy)ethoxy)benzylidene)5imino2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
844463827
CCc1ccccc1OCCOc1ccc(cc1Cl)C=C1C(=O)N=c2n(C1=N)nc(s2)c1cccnc1
MFCD04157166
ZINC000100944828
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