Vitas-M small molecule compound

N-(4-methoxybenzyl)-2-[(4-nitrobenzyl)sulfanyl]acetamide

Catalog ID
STL102130
SMILES COc1ccc(cc1)CNC(=O)CSCc1ccc(cc1)[N+](=O)[O-]

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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 C17H18N2O4S MW 346.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2O4S/c1-23-16-8-4-13(5-9-16)10-18-17(20)12-24-11-14-2-6-15(7-3-14)19(21)22/h2-9H,10-12H2,1H3,(H,18,20)
InChIKey
PSCPVCZENUNDCC-UHFFFAOYSA-N
Synonyms

COC1=CC=C(C=C1)CNC(=O)CSCC2=CC=C(C=C2)(N+)(=O)(O)
COc1ccc(cc1)CNC(=O)CSCc1ccc(cc1)(N+)(=O)(O)
InChI=1SC17H18N2O4Sc123168413(5916)101817(20)122411142615(7314)19(21)22h29H1012H21H3(H1820)
MFCD03136545
N((4METHOXYPHENYL)METHYL)2((4NITROPHENYL)METHYLSULFANYL)ACETAMIDE
N(4methoxybenzyl)2((4nitrobenzyl)sulfanyl)acetamide
ZINC000000454527
ZINC00454527
ZINC454527

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Available files

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