Vitas-M small molecule compound

S-(4-chlorophenyl) (6,7-dimethyl-1-benzofuran-3-yl)ethanethioate

Catalog ID
STK910550
SMILES O=C(Cc1coc2c1ccc(c2C)C)Sc1ccc(cc1)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 C18H15ClO2S MW 330.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15ClO2S/c1-11-3-8-16-13(10-21-18(16)12(11)2)9-17(20)22-15-6-4-14(19)5-7-15/h3-8,10H,9H2,1-2H3
InChIKey
YTMZZMZZJQRFRU-UHFFFAOYSA-N
Synonyms

CC1=C(C2=C(C=C1)C(=CO2)CC(=O)SC3=CC=C(C=C3)Cl)C
InChI=1SC18H15ClO2Sc111381613(102118(16)12(11)2)917(20)22156414(19)5715h3810H9H212H3
MFCD07425503
S(4chlorophenyl)(67dimethyl1benzofuran3yl)ethanethioate
S(4chlorophenyl)2(67dimethyl1benzofuran3yl)ethanethioate
ZINC000008869267
ZINC08869267
ZINC8869267

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Available files

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