Vitas-M small molecule compound
(6Z)-6-{3-ethoxy-4-[2-(3-methylphenoxy)ethoxy]benzylidene}-5-imino-2-(pyridin-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK554980
SMILES CCOc1cc(ccc1OCCOc1cccc(c1)C)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)c1cccnc1
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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 C28H25N5O4S MW 527.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N5O4S/c1-3-35-24-16-19(9-10-23(24)37-13-12-36-21-8-4-6-18(2)14-21)15-22-25(29)33-28(31-26(22)34)38-27(32-33)20-7-5-11-30-17-20/h4-11,14-17,29H,3,12-13H2,1-2H3/b22-15-,29-25-InChIKey
OTSYZMDFKURKDW-RORORGNRSA-NSynonyms
840495-61-6(6Z)6(3ethoxy4(2(3methylphenoxy)ethoxy)benzylidene)5imino2(pyridin3yl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)6(3ethoxy4(2(mtolyloxy)ethoxy)benzylidene)5imino2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
840495616
CCOc1cc(ccc1OCCOc1cccc(c1)C)C=C1C(=O)N=c2n(C1=N)nc(s2)c1cccnc1
MFCD04008020
ZINC000101033078
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