Vitas-M small molecule compound
2-[(4-{[6-acetyl-5-(2-methoxynaphthalen-1-yl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene]methyl}-2-ethoxyphenoxy)methyl]benzonitrile
Catalog ID
STK330223
SMILES CCOc1cc(ccc1OCc1ccccc1C#N)/C=c/1\sc2=NC(=C(C(n2c1=O)c1c(OC)ccc2c1cccc2)C(=O)C)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 C37H31N3O5S MW 629.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H31N3O5S/c1-5-44-31-18-24(14-16-29(31)45-21-27-12-7-6-11-26(27)20-38)19-32-36(42)40-35(33(23(3)41)22(2)39-37(40)46-32)34-28-13-9-8-10-25(28)15-17-30(34)43-4/h6-19,35H,5,21H2,1-4H3/b32-19+InChIKey
UEKQUEYZVKCVPM-BIZUNTBRSA-NSynonyms
2((4((6acetyl5(2methoxynaphthalen1yl)7methyl3oxo5H(13)thiazolo(32a)pyrimidin2(3H)ylidene)methyl)2ethoxyphenoxy)methyl)benzonitrile
CCOc1cc(ccc1OCc1ccccc1C#N)C=c1sc2=NC(=C(C(n2c1=O)c1c(OC)ccc2c1cccc2)C(=O)C)C
MFCD01787549
ZINC000245328206
ZINC000245328210
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