Vitas-M small molecule compound
(6E)-2-ethyl-6-{4-[2-(3-ethyl-5-methylphenoxy)ethoxy]benzylidene}-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK014149
SMILES CCc1cc(OCCOc2ccc(cc2)/C=C\2/C(=O)N=c3n(C2=N)nc(s3)CC)cc(c1)C
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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 C25H26N4O3S MW 462.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O3S/c1-4-17-12-16(3)13-20(14-17)32-11-10-31-19-8-6-18(7-9-19)15-21-23(26)29-25(27-24(21)30)33-22(5-2)28-29/h6-9,12-15,26H,4-5,10-11H2,1-3H3/b21-15+,26-23+InChIKey
SSODIVPQKJZECO-YUMIBIHSSA-NSynonyms
(6E)2ethyl6(4(2(3ethyl5methylphenoxy)ethoxy)benzylidene)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)2ethyl6(4(2(3ethyl5methylphenoxy)ethoxy)benzylidene)5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
CCc1cc(OCCOc2ccc(cc2)C=C2C(=O)N=c3n(C2=N)nc(s3)CC)cc(c1)C
MFCD03183244
STK014149
ZINC000008984025
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