Vitas-M small molecule compound
(6Z)-6-{4-[2-(4-chloro-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
STK555591
SMILES O=C1N=c2sc(nn2C(=N)/C/1=C/c1ccc(cc1)OCCOc1ccc(c(c1)C)Cl)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 C26H20ClN5O3S MW 518.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20ClN5O3S/c1-16-13-20(8-9-22(16)27)35-12-11-34-19-6-4-17(5-7-19)14-21-23(28)32-26(30-24(21)33)36-25(31-32)18-3-2-10-29-15-18/h2-10,13-15,28H,11-12H2,1H3/b21-14-,28-23-InChIKey
AWIGHPMHHRCWKY-MELYVXEGSA-NSynonyms
842959-31-3(6Z)6(4(2(4chloro3methylphenoxy)ethoxy)benzylidene)5imino2(pyridin3yl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)6(4(2(4chloro3methylphenoxy)ethoxy)benzylidene)5imino2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
842959313
MFCD04012251
O=C1N=c2sc(nn2C(=N)C1=Cc1ccc(cc1)OCCOc1ccc(c(c1)C)Cl)c1cccnc1
ZINC000009455022
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