Vitas-M small molecule compound

1-(4-tert-butylphenyl)-2-{[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}ethanone

Catalog ID
STK205390
SMILES O=C(c1ccc(cc1)C(C)(C)C)CSc1nnc(o1)c1ccco1

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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 C18H18N2O3S MW 342.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O3S/c1-18(2,3)13-8-6-12(7-9-13)14(21)11-24-17-20-19-16(23-17)15-5-4-10-22-15/h4-10H,11H2,1-3H3
InChIKey
CXKLSBJFPXWJPZ-UHFFFAOYSA-N
Synonyms

1(4TERTBUTYLPHENYL)2((5(2FURYL)134OXADIAZOL2YL)SULFANYL)ETHANONE
1(4TERTBUTYLPHENYL)2((5(FURAN2YL)134OXADIAZOL2YL)SULFANYL)ETHANONE
CC(C)(C)C1=CC=C(C=C1)C(=O)CSC2=NN=C(O2)C3=CC=CO3
InChI=1SC18H18N2O3Sc118(23)138612(7913)14(21)112417201916(2317)1554102215h410H11H213H3
MFCD04273973
ZINC000004740811
ZINC04740811
ZINC4740811

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Available files

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