Vitas-M small molecule compound
(6Z)-2-butyl-6-{3-chloro-5-methoxy-4-[2-(4-methoxyphenoxy)ethoxy]benzylidene}-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK071993
SMILES CCCCc1sc2=NC(=O)/C(=C\c3cc(Cl)c(c(c3)OC)OCCOc3ccc(cc3)OC)/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 C26H27ClN4O5S MW 543.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27ClN4O5S/c1-4-5-6-22-30-31-24(28)19(25(32)29-26(31)37-22)13-16-14-20(27)23(21(15-16)34-3)36-12-11-35-18-9-7-17(33-2)8-10-18/h7-10,13-15,28H,4-6,11-12H2,1-3H3/b19-13-,28-24-InChIKey
YLYUYYNFODKZBJ-PLVQEJQLSA-NSynonyms
(6Z)2butyl6(3chloro5methoxy4(2(4methoxyphenoxy)ethoxy)benzylidene)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCCCc1sc2=NC(=O)C(=Cc3cc(Cl)c(c(c3)OC)OCCOc3ccc(cc3)OC)C(=N)n2n1
MFCD08672815
STK071993
ZINC000100710590
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