Vitas-M small molecule compound

2-({2-[(2-fluorophenyl)amino]-2-oxoethyl}sulfanyl)benzoic acid

Catalog ID
STK663655
SMILES O=C(Nc1ccccc1F)CSc1ccccc1C(=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 C15H12FNO3S MW 305.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12FNO3S/c16-11-6-2-3-7-12(11)17-14(18)9-21-13-8-4-1-5-10(13)15(19)20/h1-8H,9H2,(H,17,18)(H,19,20)
InChIKey
XOTPQGNCZGARQA-UHFFFAOYSA-N
Synonyms
385382-63-8
2((((2FLUOROPHENYL)CARBAMOYL)METHYL)SULFANYL)BENZOICACID
2((2((2fluorophenyl)amino)2oxoethyl)sulfanyl)benzoicacid
2((2((2FLUOROPHENYL)AMINO)2OXOETHYL)THIO)BENZOICACID
2((2(2FLUOROANILINO)2OXOETHYL)SULFANYL)BENZOICACID
2((2(2FLUOROANILINO)2OXOETHYL)SULPHANYL)BENZOICACID
2((2FLUOROPHENYLCARBAMOYL)METHYLSULFANYL)BENZOICACID
2((N(2FLUOROPHENYL)CARBAMOYL)METHYLTHIO)BENZOICACID
2(2(2FLUOROANILINO)2OXOETHYL)SULFANYLBENZOICACID
385382638
C1=CC=C(C(=C1)C(=O)O)SCC(=O)NC2=CC=CC=C2F
InChI=1SC15H12FNO3Sc1611623712(11)1714(18)92113841510(13)15(19)20h18H9H2(H1718)(H1920)
MFCD02933429
ZINC000000089061
ZINC89061

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Available files

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