Vitas-M small molecule compound

N-(4-bromobenzyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Catalog ID
STL028204
SMILES Brc1ccc(cc1)CNC(=O)c1cc2c(s1)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 C16H16BrNOS MW 350.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16BrNOS/c17-13-7-5-11(6-8-13)10-18-16(19)15-9-12-3-1-2-4-14(12)20-15/h5-9H,1-4,10H2,(H,18,19)
InChIKey
DDELVZIFINHSQQ-UHFFFAOYSA-N
Synonyms

C1CCC2=C(C1)C=C(S2)C(=O)NCC3=CC=C(C=C3)Br
InChI=1SC16H16BrNOSc17137511(6813)101816(19)15912312414(12)2015h59H1410H2(H1819)
MFCD18188742
N((4bromophenyl)methyl)4567tetrahydro1benzothiophene2carboxamide
N(4bromobenzyl)4567tetrahydro1benzothiophene2carboxamide
ZINC000057416272
ZINC57416272

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Available files

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