Vitas-M small molecule compound
(6E)-6-{3-ethoxy-4-[2-(2-methylphenoxy)ethoxy]benzylidene}-2-ethyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK094543
SMILES CCOc1cc(ccc1OCCOc1ccccc1C)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)CC
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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 C25H26N4O4S MW 478.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O4S/c1-4-22-28-29-23(26)18(24(30)27-25(29)34-22)14-17-10-11-20(21(15-17)31-5-2)33-13-12-32-19-9-7-6-8-16(19)3/h6-11,14-15,26H,4-5,12-13H2,1-3H3/b18-14+,26-23+InChIKey
IFKNPMIXOPDQSS-CTVSUGDZSA-NSynonyms
(6E)6(3ethoxy4(2(2methylphenoxy)ethoxy)benzylidene)2ethyl5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)6(3ethoxy4(2(otolyloxy)ethoxy)benzylidene)2ethyl5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
CCOc1cc(ccc1OCCOc1ccccc1C)C=C1C(=O)N=c2n(C1=N)nc(s2)CC
MFCD03183264
STK094543
ZINC000013895311
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