Vitas-M small molecule compound

2-{[2-(benzylsulfanyl)propanoyl]amino}-4-chlorobenzoic acid

Catalog ID
STK292680
SMILES O=C(C(SCc1ccccc1)C)Nc1cc(Cl)ccc1C(=O)O

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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/c1-11(23-10-12-5-3-2-4-6-12)16(20)19-15-9-13(18)7-8-14(15)17(21)22/h2-9,11H,10H2,1H3,(H,19,20)(H,21,22)
InChIKey
ZJTIWRULFBVAOI-UHFFFAOYSA-N
Synonyms
890992-58-2
2((2(benzylsulfanyl)propanoyl)amino)4chlorobenzoicacid
2(2benzylsulfanylpropanoylamino)4chlorobenzoicacid
890992582
CC(C(=O)NC1=C(C=CC(=C1)Cl)C(=O)O)SCC2=CC=CC=C2
InChI=1SC17H16ClNO3Sc111(2310125324612)16(20)1915913(18)7814(15)17(21)22h2911H10H21H3(H1920)(H2122)
MFCD07114953
ZINC000008215033
ZINC000008215035

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Available files

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