Vitas-M small molecule compound
(6E)-2-butyl-5-imino-6-{3-iodo-5-methoxy-4-[2-(2-methylphenoxy)ethoxy]benzylidene}-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK092883
SMILES CCCCc1sc2=NC(=O)/C(=C/c3cc(I)c(c(c3)OC)OCCOc3ccccc3C)/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 C26H27IN4O4S MW 618.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27IN4O4S/c1-4-5-10-22-30-31-24(28)18(25(32)29-26(31)36-22)13-17-14-19(27)23(21(15-17)33-3)35-12-11-34-20-9-7-6-8-16(20)2/h6-9,13-15,28H,4-5,10-12H2,1-3H3/b18-13+,28-24+InChIKey
BPAXGFBWAKRKDQ-YTPPKWQLSA-NSynonyms
(6E)2butyl5imino6(3iodo5methoxy4(2(2methylphenoxy)ethoxy)benzylidene)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCCCc1sc2=NC(=O)C(=Cc3cc(I)c(c(c3)OC)OCCOc3ccccc3C)C(=N)n2n1
MFCD03183353
STK092883
ZINC000097959232
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