Vitas-M small molecule compound

ethyl 5-{[(4-tert-butylphenyl)sulfonyl]amino}-6-methyl-2-phenyl-1-benzofuran-3-carboxylate

Catalog ID
STK229946
SMILES CCOC(=O)c1c(oc2c1cc(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c(c2)C)c1ccccc1

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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 C28H29NO5S MW 491.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29NO5S/c1-6-33-27(30)25-22-17-23(18(2)16-24(22)34-26(25)19-10-8-7-9-11-19)29-35(31,32)21-14-12-20(13-15-21)28(3,4)5/h7-17,29H,6H2,1-5H3
InChIKey
HAOODDXSQCLWMN-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(OC2=CC(=C(C=C21)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C)C)C4=CC=CC=C4
ethyl5(((4tertbutylphenyl)sulfonyl)amino)6methyl2phenyl1benzofuran3carboxylate
ETHYL5((4TERTBUTYLPHENYL)SULFONYLAMINO)6METHYL2PHENYL1BENZOFURAN3CARBOXYLATE
InChI=1SC28H29NO5Sc163327(30)25221723(18(2)1624(22)3426(25)19108791119)2935(3132)21141220(131521)28(34)5h71729H6H215H3
MFCD07330338
ZINC000008870332
ZINC08870332
ZINC8870332

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Available files

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