Vitas-M small molecule compound

2-[(4-bromobenzyl)sulfanyl]-N-tert-butylacetamide

Catalog ID
STK358168
SMILES O=C(NC(C)(C)C)CSCc1ccc(cc1)Br

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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 C13H18BrNOS MW 316.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H18BrNOS/c1-13(2,3)15-12(16)9-17-8-10-4-6-11(14)7-5-10/h4-7H,8-9H2,1-3H3,(H,15,16)
InChIKey
NUGUPTNJCRIOMC-UHFFFAOYSA-N
Synonyms
714213-30-6
2((4BROMOBENZYL)SULFANYL)NTERTBUTYLACETAMIDE
2((4BROMOBENZYL)THIO)N(TERTBUTYL)ACETAMIDE
2((4BROMOPHENYL)METHYLSULFANYL)NTERTBUTYLACETAMIDE
714213306
CC(C)(C)NC(=O)CSCC1=CC=C(C=C1)Br
InChI=1SC13H18BrNOSc113(23)1512(16)9178104611(14)7510h47H89H213H3(H1516)
MFCD06002427
ZINC000001078358
ZINC01078358
ZINC1078358

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Available files

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