Vitas-M small molecule compound
N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(4-methoxybenzyl)-2-nitrobenzamide
Catalog ID
STK800434
SMILES COc1ccc(cc1)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 C19H20N2O6S MW 404.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O6S/c1-27-16-8-6-14(7-9-16)12-20(15-10-11-28(25,26)13-15)19(22)17-4-2-3-5-18(17)21(23)24/h2-9,15H,10-13H2,1H3InChIKey
LKFBJNPBDKLAFS-UHFFFAOYSA-NSynonyms
620556-01-6620556016
COC1=CC=C(C=C1)CN(C2CCS(=O)(=O)C2)C(=O)C3=CC=CC=C3(N+)(=O)(O)
COc1ccc(cc1)CN(C(=O)c1ccccc1(N+)(=O)(O))C1CCS(=O)(=O)C1
InChI=1SC19H20N2O6Sc127168614(7916)1220(15101128(2526)1315)19(22)17423518(17)21(23)24h2915H1013H21H3
MFCD04160795
N(11dioxidotetrahydrothiophen3yl)N(4methoxybenzyl)2nitrobenzamide
N(11DIOXOTHIOLAN3YL)N((4METHOXYPHENYL)METHYL)2NITROBENZAMIDE
ZINC000004318648
ZINC000004318650
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