Vitas-M small molecule compound

ethyl (2Z)-5-(4-ethoxyphenyl)-2-(furan-2-ylmethylidene)-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STL164232
SMILES CCOC(=O)C1=C(N=c2n(C1c1ccc(cc1)OCC)c(=O)/c(=C/c1ccco1)/s2)c1ccccc1

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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 C28H24N2O5S MW 500.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N2O5S/c1-3-33-20-14-12-19(13-15-20)25-23(27(32)34-4-2)24(18-9-6-5-7-10-18)29-28-30(25)26(31)22(36-28)17-21-11-8-16-35-21/h5-17,25H,3-4H2,1-2H3/b22-17-
InChIKey
GGRCHJMHKKFEJV-XLNRJJMWSA-N
Synonyms

CCOC(=O)C1=C(N=c2n(C1c1ccc(cc1)OCC)c(=O)c(=Cc1ccco1)s2)c1ccccc1
CCOC1=CC=C(C=C1)C2C(=C(N=C3N2C(=O)C(=CC4=CC=CO4)S3)C5=CC=CC=C5)C(=O)OCC
ethyl(2Z)5(4ethoxyphenyl)2(furan2ylmethylidene)3oxo7phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(4ETHOXYPHENYL)2(FURAN2YLMETHYLIDENE)3OXO7PHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL5(4ETHOXYPHENYL)2(2FURYLMETHYLENE)3OXO7PHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC28H24N2O5Sc133320141219(131520)2523(27(32)3442)24(1896571018)292830(25)26(31)22(3628)1721118163521h51725H34H212H3b2217
MFCD02632102
ZINC000002049596
ZINC000002049598

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.