Vitas-M small molecule compound

2-(1,3-benzoxazol-2-ylsulfanyl)-1-(4-tert-butylphenyl)ethanone

Catalog ID
STK205474
SMILES O=C(c1ccc(cc1)C(C)(C)C)CSc1nc2c(o1)cccc2

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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 C19H19NO2S MW 325.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19NO2S/c1-19(2,3)14-10-8-13(9-11-14)16(21)12-23-18-20-15-6-4-5-7-17(15)22-18/h4-11H,12H2,1-3H3
InChIKey
HLLKPUPVBVGVMX-UHFFFAOYSA-N
Synonyms

2(13BENZOXAZOL2YLSULFANYL)1(4TERTBUTYLPHENYL)ETHANONE
CC(C)(C)C1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3O2
InChI=1SC19H19NO2Sc119(23)1410813(91114)16(21)1223182015645717(15)2218h411H12H213H3
MFCD04274372
ZINC000004740826
ZINC04740826
ZINC4740826

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Available files

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