Vitas-M small molecule compound

tert-butyl 4-[(1,3-benzodioxol-5-ylmethyl)carbamoyl]-2-(4-chlorophenyl)-1,3-thiazolidine-3-carboxylate

Catalog ID
STK135405
SMILES Clc1ccc(cc1)C1SCC(N1C(=O)OC(C)(C)C)C(=O)NCc1ccc2c(c1)OCO2

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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 C23H25ClN2O5S MW 476.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25ClN2O5S/c1-23(2,3)31-22(28)26-17(12-32-21(26)15-5-7-16(24)8-6-15)20(27)25-11-14-4-9-18-19(10-14)30-13-29-18/h4-10,17,21H,11-13H2,1-3H3,(H,25,27)
InChIKey
MMFZEGXHMZCUGV-UHFFFAOYSA-N
Synonyms

CC(C)(C)OC(=O)N1C(CSC1C2=CC=C(C=C2)Cl)C(=O)NCC3=CC4=C(C=C3)OCO4
InChI=1SC23H25ClN2O5Sc123(23)3122(28)2617(123221(26)155716(24)8615)20(27)251114491819(1014)30132918h4101721H1113H213H3(H2527)
MFCD09267525
TERTBUTYL4((13BENZODIOXOL5YLMETHYL)CARBAMOYL)2(4CHLOROPHENYL)13THIAZOLIDINE3CARBOXYLATE
tertbutyl4(13benzodioxol5ylmethylcarbamoyl)2(4chlorophenyl)13thiazolidine3carboxylate
ZINC000009850946
ZINC000009850951

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Available files

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