Vitas-M small molecule compound
(6Z)-6-{3-ethoxy-4-[2-(2-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
STK558448
SMILES CCOc1cc(ccc1OCCOc1ccccc1C)/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(10-11-23(24)37-14-13-36-22-9-5-4-7-18(22)2)15-21-25(29)33-28(31-26(21)34)38-27(32-33)20-8-6-12-30-17-20/h4-12,15-17,29H,3,13-14H2,1-2H3/b21-15-,29-25-InChIKey
GLYQCYURFKIXBV-XKWYAVLBSA-NSynonyms
587003-73-4(6Z)6(3ethoxy4(2(2methylphenoxy)ethoxy)benzylidene)5imino2(pyridin3yl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)6(3ethoxy4(2(otolyloxy)ethoxy)benzylidene)5imino2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
587003734
CCOc1cc(ccc1OCCOc1ccccc1C)C=C1C(=O)N=c2n(C1=N)nc(s2)c1cccnc1
MFCD04032287
ZINC000101087397
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