Vitas-M small molecule compound

ethyl 4-({(2E)-2-[(3,4-dimethylphenyl)imino]-4-oxo-1,3-thiazolidin-5-yl}methyl)benzoate

Catalog ID
STK949261
SMILES CCOC(=O)c1ccc(cc1)CC1S/C(=N/c2ccc(c(c2)C)C)/NC1=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 C21H22N2O3S MW 382.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O3S/c1-4-26-20(25)16-8-6-15(7-9-16)12-18-19(24)23-21(27-18)22-17-10-5-13(2)14(3)11-17/h5-11,18H,4,12H2,1-3H3,(H,22,23,24)
InChIKey
QRUDRDIJGNUXGO-UHFFFAOYSA-N
Synonyms
620542-23-6
(E)ETHYL4((2((34DIMETHYLPHENYL)IMINO)4OXOTHIAZOLIDIN5YL)METHYL)BENZOATE
620542236
CCOC(=O)C1=CC=C(C=C1)CC2C(=O)N=C(S2)NC3=CC(=C(C=C3)C)C
CCOC(=O)c1ccc(cc1)CC1SC(=Nc2ccc(c(c2)C)C)NC1=O
ethyl4(((2E)2((34dimethylphenyl)imino)4oxo13thiazolidin5yl)methyl)benzoate
ETHYL4(((5R)2((34DIMETHYLPHENYL)AMINO)4OXO45DIHYDRO13THIAZOL5YL)METHYL)BENZOATE
ETHYL4((2((34DIMETHYLPHENYL)AZAMETHYLENE)4OXO13THIAZOLIDIN5YL)METHYL)BENZOATE
ETHYL4((2(34DIMETHYLANILINO)4OXO13THIAZOL5YL)METHYL)BENZOATE
InChI=1SC21H22N2O3Sc142620(25)168615(7916)121819(24)2321(2718)221710513(2)14(3)1117h51118H412H213H3(H222324)
MFCD04173581
ZINC000016713133
ZINC000016713135

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Available files

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