Vitas-M small molecule compound
(6E)-6-{3-bromo-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxybenzylidene}-2-ethyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK020683
SMILES CCc1sc2=NC(=O)/C(=C/c3cc(Br)c(c(c3)OC)OCCOc3ccc(c(c3)C)C)/C(=N)n2n1
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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 C25H25BrN4O4S MW 557.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25BrN4O4S/c1-5-21-29-30-23(27)18(24(31)28-25(30)35-21)11-16-12-19(26)22(20(13-16)32-4)34-9-8-33-17-7-6-14(2)15(3)10-17/h6-7,10-13,27H,5,8-9H2,1-4H3/b18-11+,27-23+InChIKey
UXHCNKGOWFNBDJ-CWLOYKQRSA-NSynonyms
(6E)6(3bromo4(2(34dimethylphenoxy)ethoxy)5methoxybenzylidene)2ethyl5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCc1sc2=NC(=O)C(=Cc3cc(Br)c(c(c3)OC)OCCOc3ccc(c(c3)C)C)C(=N)n2n1
MFCD03183282
STK020683
ZINC000097958026
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