Vitas-M small molecule compound

methyl 2-chloro-5-{[3-(phenylsulfanyl)propanoyl]amino}benzoate

Catalog ID
STL254772
SMILES COC(=O)c1cc(ccc1Cl)NC(=O)CCSc1ccccc1

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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 C17H16ClNO3S MW 349.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16ClNO3S/c1-22-17(21)14-11-12(7-8-15(14)18)19-16(20)9-10-23-13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3,(H,19,20)
InChIKey
RSUZPAHVHFHIRQ-UHFFFAOYSA-N
Synonyms

COC(=O)C1=C(C=CC(=C1)NC(=O)CCSC2=CC=CC=C2)Cl
InChI=1SC17H16ClNO3Sc12217(21)141112(7815(14)18)1916(20)91023135324613h2811H910H21H3(H1920)
methyl2chloro5((3(phenylsulfanyl)propanoyl)amino)benzoate
METHYL2CHLORO5(3PHENYLSULFANYLPROPANOYLAMINO)BENZOATE
MFCD04350658
ZINC000000621383
ZINC00621383
ZINC621383

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Available files

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