Vitas-M small molecule compound

ethyl (2E)-2-(4-fluorobenzylidene)-7-methyl-3-oxo-5-[2-(propan-2-yloxy)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STL381803
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1OC(C)C)c(=O)/c(=C\c1ccc(cc1)F)/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 C26H25FN2O4S MW 480.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25FN2O4S/c1-5-32-25(31)22-16(4)28-26-29(23(22)19-8-6-7-9-20(19)33-15(2)3)24(30)21(34-26)14-17-10-12-18(27)13-11-17/h6-15,23H,5H2,1-4H3/b21-14+
InChIKey
GEHDIGWGKGSKAG-KGENOOAVSA-N
Synonyms

CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1OC(C)C)c(=O)c(=Cc1ccc(cc1)F)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3OC(C)C)C(=O)C(=CC4=CC=C(C=C4)F)S2)C
ethyl(2E)2((4fluorophenyl)methylidene)7methyl3oxo5(2propan2yloxyphenyl)5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)2(4fluorobenzylidene)7methyl3oxo5(2(propan2yloxy)phenyl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL2((4FLUOROPHENYL)METHYLENE)7METHYL5(2(METHYLETHOXY)PHENYL)3OXO45DIHYDRO13THIAZOLIDINO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC26H25FN2O4Sc153225(31)2216(4)282629(23(22)19867920(19)3315(2)3)24(30)21(3426)1417101218(27)131117h61523H5H214H3b2114+
MFCD03548161
ZINC000016682432
ZINC000016682433

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Available files

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