Vitas-M small molecule compound

ethyl 3-(2-chlorophenyl)-3-{[(2-oxo-1,3-benzothiazol-3(2H)-yl)acetyl]amino}propanoate

Catalog ID
STK777648
SMILES CCOC(=O)CC(c1ccccc1Cl)NC(=O)Cn1c(=O)sc2c1cccc2

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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 C20H19ClN2O4S MW 418.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClN2O4S/c1-2-27-19(25)11-15(13-7-3-4-8-14(13)21)22-18(24)12-23-16-9-5-6-10-17(16)28-20(23)26/h3-10,15H,2,11-12H2,1H3,(H,22,24)
InChIKey
KAXGSTKLFWIOQS-UHFFFAOYSA-N
Synonyms

CCOC(=O)CC(C1=CC=CC=C1Cl)NC(=O)CN2C3=CC=CC=C3SC2=O
ethyl3(2chlorophenyl)3(((2oxo13benzothiazol3(2H)yl)acetyl)amino)propanoate
ETHYL3(2CHLOROPHENYL)3((2(2OXO13BENZOTHIAZOL3YL)ACETYL)AMINO)PROPANOATE
InChI=1SC20H19ClN2O4Sc122719(25)1115(13734814(13)21)2218(24)1223169561017(16)2820(23)26h31015H21112H21H3(H2224)
MFCD05854778
ZINC000004694244
ZINC000004694246

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Available files

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