Vitas-M small molecule compound

tert-butyl 4-(benzylcarbamoyl)-2-(4-chlorophenyl)-1,3-thiazolidine-3-carboxylate

Catalog ID
STK131680
SMILES O=C(C1CSC(N1C(=O)OC(C)(C)C)c1ccc(cc1)Cl)NCc1ccccc1

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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 C22H25ClN2O3S MW 432.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25ClN2O3S/c1-22(2,3)28-21(27)25-18(19(26)24-13-15-7-5-4-6-8-15)14-29-20(25)16-9-11-17(23)12-10-16/h4-12,18,20H,13-14H2,1-3H3,(H,24,26)
InChIKey
YQLUPEABRRTZJK-UHFFFAOYSA-N
Synonyms

CC(C)(C)OC(=O)N1C(CSC1C2=CC=C(C=C2)Cl)C(=O)NCC3=CC=CC=C3
InChI=1SC22H25ClN2O3Sc122(23)2821(27)2518(19(26)2413157546815)142920(25)1691117(23)121016h4121820H1314H213H3(H2426)
MFCD09267504
TERTBUTYL4(BENZYLCARBAMOYL)2(4CHLOROPHENYL)13THIAZOLIDINE3CARBOXYLATE
ZINC000009850277
ZINC000009850280

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Available files

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