Vitas-M small molecule compound

ethyl 4-({(5Z)-5-[4-(dimethylamino)benzylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}methyl)benzoate

Catalog ID
STK215723
SMILES CCOC(=O)c1ccc(cc1)CN1C(=O)S/C(=C\c2ccc(cc2)N(C)C)/C1=O

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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 C22H22N2O4S MW 410.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O4S/c1-4-28-21(26)17-9-5-16(6-10-17)14-24-20(25)19(29-22(24)27)13-15-7-11-18(12-8-15)23(2)3/h5-13H,4,14H2,1-3H3/b19-13-
InChIKey
IVBXEUAUAGLHLB-UYRXBGFRSA-N
Synonyms
871323-68-1
871323681
CCOC(=O)C1=CC=C(C=C1)CN2C(=O)C(=CC3=CC=C(C=C3)N(C)C)SC2=O
CCOC(=O)c1ccc(cc1)CN1C(=O)SC(=Cc2ccc(cc2)N(C)C)C1=O
ethyl4(((5Z)5((4(dimethylamino)phenyl)methylidene)24dioxo13thiazolidin3yl)methyl)benzoate
ETHYL4(((5Z)5((4DIMETHYLAMINOPHENYL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)METHYL)BENZOATE
ETHYL4(((5Z)5(4(DIMETHYLAMINO)BENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)METHYL)BENZOATE
ETHYL4((5((4(DIMETHYLAMINO)PHENYL)METHYLENE)24DIOXO13THIAZOLIDIN3YL)METHYL)BENZOATE
InChI=1SC22H22N2O4Sc142821(26)179516(61017)142420(25)19(2922(24)27)131571118(12815)23(2)3h513H414H213H3b1913
MFCD07190254
ZINC000004193883
ZINC04193883
ZINC4193883

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Available files

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