Vitas-M small molecule compound

methyl {2-chloro-6-ethoxy-4-[(E)-(3-{2-[(4-methylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy}acetate

Catalog ID
STK157540
SMILES CCOc1cc(/C=C\2/SC(=O)N(C2=O)CC(=O)Nc2ccc(cc2)C)cc(c1OCC(=O)OC)Cl

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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 C24H23ClN2O7S MW 518.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23ClN2O7S/c1-4-33-18-10-15(9-17(25)22(18)34-13-21(29)32-3)11-19-23(30)27(24(31)35-19)12-20(28)26-16-7-5-14(2)6-8-16/h5-11H,4,12-13H2,1-3H3,(H,26,28)/b19-11+
InChIKey
PIEFYIFNORKLLX-YBFXNURJSA-N
Synonyms

CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=O)S2)CC(=O)NC3=CC=C(C=C3)C)Cl)OCC(=O)OC
CCOc1cc(C=C2SC(=O)N(C2=O)CC(=O)Nc2ccc(cc2)C)cc(c1OCC(=O)OC)Cl
InChI=1SC24H23ClN2O7Sc1433181015(917(25)22(18)341321(29)323)111923(30)27(24(31)3519)1220(28)26167514(2)6816h511H41213H213H3(H2628)b1911+
METHYL(2CHLORO6ETHOXY4((E)(3(2((4METHYLPHENYL)AMINO)2OXOETHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)PHENOXY)ACETATE
METHYL2(2CHLORO6ETHOXY4((3((N(4METHYLPHENYL)CARBAMOYL)METHYL)24DIOXO(13THIAZOLIDIN5YLIDENE))METHYL)PHENOXY)ACETATE
methyl2(2chloro6ethoxy4((E)(3(2(4methylanilino)2oxoethyl)24dioxo13thiazolidin5ylidene)methyl)phenoxy)acetate
MFCD04493272
ZINC000012411412
ZINC12411412

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Available files

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