Vitas-M small molecule compound
(6Z)-6-{3-ethoxy-4-[(2-methylbenzyl)oxy]benzylidene}-5-imino-2-(pyridin-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK556823
SMILES CCOc1cc(ccc1OCc1ccccc1C)/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 C27H23N5O3S MW 497.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N5O3S/c1-3-34-23-14-18(10-11-22(23)35-16-20-8-5-4-7-17(20)2)13-21-24(28)32-27(30-25(21)33)36-26(31-32)19-9-6-12-29-15-19/h4-15,28H,3,16H2,1-2H3/b21-13-,28-24-InChIKey
WODBXFXXLNJFPU-BSAKSWINSA-NSynonyms
573943-14-3(6Z)6(3ethoxy4((2methylbenzyl)oxy)benzylidene)5imino2(pyridin3yl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)6(3ethoxy4((2methylbenzyl)oxy)benzylidene)5imino2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
573943143
CCOc1cc(ccc1OCc1ccccc1C)C=C1C(=O)N=c2n(C1=N)nc(s2)c1cccnc1
MFCD04020681
ZINC000009424046
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