Vitas-M small molecule compound
(6Z)-2-cyclohexyl-5-imino-6-{3-methoxy-4-[2-(2-methoxyphenoxy)ethoxy]benzylidene}-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK078856
SMILES COc1cc(ccc1OCCOc1ccccc1OC)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)C1CCCCC1
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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 C28H30N4O5S MW 534.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N4O5S/c1-34-21-10-6-7-11-22(21)36-14-15-37-23-13-12-18(17-24(23)35-2)16-20-25(29)32-28(30-26(20)33)38-27(31-32)19-8-4-3-5-9-19/h6-7,10-13,16-17,19,29H,3-5,8-9,14-15H2,1-2H3/b20-16-,29-25-InChIKey
IXYPBJDPJKUOAQ-TVGNBBNESA-NSynonyms
(6Z)2cyclohexyl5imino6(3methoxy4(2(2methoxyphenoxy)ethoxy)benzylidene)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
COc1cc(ccc1OCCOc1ccccc1OC)C=C1C(=O)N=c2n(C1=N)nc(s2)C1CCCCC1
MFCD02914711
STK078856
ZINC000097966226
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