Vitas-M small molecule compound
N-(3-bromobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-nitrobenzamide
Catalog ID
STK590998
SMILES Brc1cccc(c1)CN(C(=O)c1ccccc1[N+](=O)[O-])C1CCS(=O)(=O)C1
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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 C18H17BrN2O5S MW 453.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17BrN2O5S/c19-14-5-3-4-13(10-14)11-20(15-8-9-27(25,26)12-15)18(22)16-6-1-2-7-17(16)21(23)24/h1-7,10,15H,8-9,11-12H2InChIKey
VGULNLHYUPZCCO-UHFFFAOYSA-NSynonyms
850194-38-6850194386
Brc1cccc(c1)CN(C(=O)c1ccccc1(N+)(=O)(O))C1CCS(=O)(=O)C1
C1CS(=O)(=O)CC1N(CC2=CC(=CC=C2)Br)C(=O)C3=CC=CC=C3(N+)(=O)(O)
InChI=1SC18H17BrN2O5Sc191453413(1014)1120(158927(2526)1215)18(22)16612717(16)21(23)24h171015H891112H2
MFCD05690967
N((3BROMOPHENYL)METHYL)N(11DIOXOTHIOLAN3YL)2NITROBENZAMIDE
N(3bromobenzyl)N(11dioxidotetrahydrothiophen3yl)2nitrobenzamide
ZINC000009357322
ZINC000009357326
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