Vitas-M small molecule compound
(6Z)-6-{3-[2-(3,4-dimethylphenoxy)ethoxy]benzylidene}-5-imino-2-(phenoxymethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK076015
SMILES O=C1N=c2sc(nn2C(=N)/C/1=C/c1cccc(c1)OCCOc1ccc(c(c1)C)C)COc1ccccc1
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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 C29H26N4O4S MW 526.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N4O4S/c1-19-11-12-24(15-20(19)2)36-14-13-35-23-10-6-7-21(16-23)17-25-27(30)33-29(31-28(25)34)38-26(32-33)18-37-22-8-4-3-5-9-22/h3-12,15-17,30H,13-14,18H2,1-2H3/b25-17-,30-27-InChIKey
ZYIZVIRTIQLFNT-FHLNGXDCSA-NSynonyms
(6Z)6(3(2(34dimethylphenoxy)ethoxy)benzylidene)5imino2(phenoxymethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
MFCD03183186
O=C1N=c2sc(nn2C(=N)C1=Cc1cccc(c1)OCCOc1ccc(c(c1)C)C)COc1ccccc1
STK076015
ZINC000008493700
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