Vitas-M small molecule compound

2-(benzylsulfanyl)-N-(4-methylphenyl)-4-nitrobenzamide

Catalog ID
STK766447
SMILES Cc1ccc(cc1)NC(=O)c1ccc(cc1SCc1ccccc1)[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 C21H18N2O3S MW 378.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O3S/c1-15-7-9-17(10-8-15)22-21(24)19-12-11-18(23(25)26)13-20(19)27-14-16-5-3-2-4-6-16/h2-13H,14H2,1H3,(H,22,24)
InChIKey
UGSUZEIEZRZRBB-UHFFFAOYSA-N
Synonyms

2(benzylsulfanyl)N(4methylphenyl)4nitrobenzamide
2BENZYLSULFANYL4NITRONPTOLYLBENZAMIDE
2BENZYLSULFANYLN(4METHYLPHENYL)4NITROBENZAMIDE
CC1=CC=C(C=C1)NC(=O)C2=C(C=C(C=C2)(N+)(=O)(O))SCC3=CC=CC=C3
Cc1ccc(cc1)NC(=O)c1ccc(cc1SCc1ccccc1)(N+)(=O)(O)
InChI=1SC21H18N2O3Sc1157917(10815)2221(24)19121118(23(25)26)1320(19)2714165324616h213H14H21H3(H2224)
MFCD03017714
N(4METHYLPHENYL)2(BENZYLTHIO)4NITROBENZAMIDE
ZINC000001446239
ZINC01446239
ZINC1446239

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Available files

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