Vitas-M small molecule compound

ethyl (2Z)-2-{3-[(2,4-difluorophenoxy)methyl]-4-methoxybenzylidene}-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STL173659
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)/c(=C/c1ccc(c(c1)COc1ccc(cc1F)F)OC)/s2

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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 C31H26F2N2O5S MW 576.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26F2N2O5S/c1-4-39-30(37)27-18(2)34-31-35(28(27)20-8-6-5-7-9-20)29(36)26(41-31)15-19-10-12-24(38-3)21(14-19)17-40-25-13-11-22(32)16-23(25)33/h5-16,28H,4,17H2,1-3H3/b26-15-
InChIKey
GBIHDHYZDOILON-YSMPRRRNSA-N
Synonyms
445035-63-2
445035632
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)c(=Cc1ccc(c(c1)COc1ccc(cc1F)F)OC)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3)C(=O)C(=CC4=CC(=C(C=C4)OC)COC5=C(C=C(C=C5)F)F)S2)C
ETHYL(2Z)2((3((24DIFLUOROPHENOXY)METHYL)4METHOXYPHENYL)METHYLIDENE)7METHYL3OXO5PHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)2(3((24difluorophenoxy)methyl)4methoxybenzylidene)7methyl3oxo5phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL2(3((24DIFLUOROPHENOXY)METHYL)4METHOXYBENZYLIDENE)7METHYL3OXO5PHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC31H26F2N2O5Sc143930(37)2718(2)343135(28(27)208657920)29(36)26(4131)1519101224(383)21(1419)174025131122(32)1623(25)33h51628H417H213H3b2615
MFCD02243121
ZINC000002106139
ZINC000002106145

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Available files

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