Vitas-M small molecule compound

methyl 4-{5-[(E)-(3-{2-[(4-methylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzoate

Catalog ID
STK153246
SMILES COC(=O)c1ccc(cc1)c1ccc(o1)/C=C\1/SC(=O)N(C1=O)CC(=O)Nc1ccc(cc1)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 C25H20N2O6S MW 476.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N2O6S/c1-15-3-9-18(10-4-15)26-22(28)14-27-23(29)21(34-25(27)31)13-19-11-12-20(33-19)16-5-7-17(8-6-16)24(30)32-2/h3-13H,14H2,1-2H3,(H,26,28)/b21-13+
InChIKey
LOWRLNKFLNJOPR-FYJGNVAPSA-N
Synonyms
431054-19-2
431054192
CC1=CC=C(C=C1)NC(=O)CN2C(=O)C(=CC3=CC=C(O3)C4=CC=C(C=C4)C(=O)OC)SC2=O
COC(=O)c1ccc(cc1)c1ccc(o1)C=C1SC(=O)N(C1=O)CC(=O)Nc1ccc(cc1)C
InChI=1SC25H20N2O6Sc1153918(10415)2622(28)142723(29)21(3425(27)31)1319111220(3319)165717(8616)24(30)322h313H14H212H3(H2628)b2113+
METHYL4(5((3((N(4METHYLPHENYL)CARBAMOYL)METHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)2FURYL)BENZOATE
METHYL4(5((E)(3(2((4METHYLPHENYL)AMINO)2OXOETHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)FURAN2YL)BENZOATE
METHYL4(5((E)(3(2(4METHYLANILINO)2OXOETHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)FURAN2YL)BENZOATE
MFCD02611723
ZINC000012447835
ZINC12447835

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Available files

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