Vitas-M small molecule compound
(6E)-6-{4-[2-(4-bromophenoxy)ethoxy]-3-methoxybenzylidene}-2-butyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK076942
SMILES CCCCc1nn2c(=NC(=O)/C(=C/c3ccc(c(c3)OC)OCCOc3ccc(cc3)Br)/C2=N)s1
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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/c1-3-4-5-22-29-30-23(27)19(24(31)28-25(30)35-22)14-16-6-11-20(21(15-16)32-2)34-13-12-33-18-9-7-17(26)8-10-18/h6-11,14-15,27H,3-5,12-13H2,1-2H3/b19-14+,27-23+InChIKey
VAWHBVQSDNYYBF-IBEDDQNHSA-NSynonyms
(6E)6(4(2(4bromophenoxy)ethoxy)3methoxybenzylidene)2butyl5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCCCc1nn2c(=NC(=O)C(=Cc3ccc(c(c3)OC)OCCOc3ccc(cc3)Br)C2=N)s1
MFCD03184138
STK076942
ZINC000097959022
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