Vitas-M small molecule compound

ethyl (2Z)-2-{[5-(4-chlorophenyl)furan-2-yl]methylidene}-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK698435
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C/c1ccc(o1)c1ccc(cc1)Cl)/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 C28H23ClN2O5S MW 535.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23ClN2O5S/c1-4-35-27(33)24-16(2)30-28-31(25(24)18-7-11-20(34-3)12-8-18)26(32)23(37-28)15-21-13-14-22(36-21)17-5-9-19(29)10-6-17/h5-15,25H,4H2,1-3H3/b23-15-
InChIKey
DLFFPFMSBOQMRY-HAHDFKILSA-N
Synonyms

(E)ethyl2((5(4chlorophenyl)furan2yl)methylene)5(4methoxyphenyl)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)c(=Cc1ccc(o1)c1ccc(cc1)Cl)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)OC)C(=O)C(=CC4=CC=C(O4)C5=CC=C(C=C5)Cl)S2)C
ethyl(2Z)2((5(4chlorophenyl)furan2yl)methylidene)5(4methoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2((5(4CHLOROPHENYL)FURAN2YL)METHYLIDENE)5(4METHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC28H23ClN2O5Sc143527(33)2416(2)302831(25(24)1871120(343)12818)26(32)23(3728)1521131422(3621)175919(29)10617h51525H4H213H3b2315
MFCD01455671
ZINC000002301667
ZINC000002301669

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Available files

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