Vitas-M small molecule compound
(6Z)-6-(4-{2-[2-(butan-2-yl)phenoxy]ethoxy}benzylidene)-5-imino-3-phenyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK063164
SMILES CCC(c1ccccc1OCCOc1ccc(cc1)/C=C/1\C(=O)N=c2n(C1=N)c(cs2)c1ccccc1)C
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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 C31H29N3O3S MW 523.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N3O3S/c1-3-21(2)25-11-7-8-12-28(25)37-18-17-36-24-15-13-22(14-16-24)19-26-29(32)34-27(23-9-5-4-6-10-23)20-38-31(34)33-30(26)35/h4-16,19-21,32H,3,17-18H2,1-2H3/b26-19-,32-29+InChIKey
PTTPESRSAFKPSV-FGBXTPJBSA-NSynonyms
(6Z)6(4(2(2(butan2yl)phenoxy)ethoxy)benzylidene)5imino3phenyl56dihydro7H(13)thiazolo(32a)pyrimidin7one
(Z)6(4(2(2(secbutyl)phenoxy)ethoxy)benzylidene)5imino3phenyl5Hthiazolo(32a)pyrimidin7(6H)one
CCC(c1ccccc1OCCOc1ccc(cc1)C=C1C(=O)N=c2n(C1=N)c(cs2)c1ccccc1)C
MFCD02987976
STK063164
ZINC000004648382
ZINC000013799520
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