Vitas-M small molecule compound

methyl 3-[(2-{[4-chloro-2-(phenylcarbonyl)phenyl]amino}-2-oxoethyl)sulfanyl]propanoate

Catalog ID
STK262349
SMILES COC(=O)CCSCC(=O)Nc1ccc(cc1C(=O)c1ccccc1)Cl

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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 C19H18ClNO4S MW 391.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClNO4S/c1-25-18(23)9-10-26-12-17(22)21-16-8-7-14(20)11-15(16)19(24)13-5-3-2-4-6-13/h2-8,11H,9-10,12H2,1H3,(H,21,22)
InChIKey
UOHRKSYVDMGSDG-UHFFFAOYSA-N
Synonyms

COC(=O)CCSCC(=O)NC1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2
InChI=1SC19H18ClNO4Sc12518(23)910261217(22)21168714(20)1115(16)19(24)135324613h2811H91012H21H3(H2122)
methyl3((2((4chloro2(phenylcarbonyl)phenyl)amino)2oxoethyl)sulfanyl)propanoate
METHYL3((N(4CHLORO2(PHENYLCARBONYL)PHENYL)CARBAMOYL)METHYLTHIO)PROPANOATE
METHYL3(2(2BENZOYL4CHLOROANILINO)2OXOETHYL)SULFANYLPROPANOATE
MFCD08547655
ZINC000007676306
ZINC07676306
ZINC7676306

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Available files

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