Vitas-M small molecule compound

N-[5-(cyclopropylsulfamoyl)-2-methyl-3-nitrophenyl]-3-methylbenzamide

Catalog ID
STK736063
SMILES Cc1cccc(c1)C(=O)Nc1cc(cc(c1C)[N+](=O)[O-])S(=O)(=O)NC1CC1

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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 C18H19N3O5S MW 389.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O5S/c1-11-4-3-5-13(8-11)18(22)19-16-9-15(10-17(12(16)2)21(23)24)27(25,26)20-14-6-7-14/h3-5,8-10,14,20H,6-7H2,1-2H3,(H,19,22)
InChIKey
XXMWATKMEIKCPA-UHFFFAOYSA-N
Synonyms

CC1=CC=CC(=C1)C(=O)NC2=CC(=CC(=C2C)(N+)(=O)(O))S(=O)(=O)NC3CC3
Cc1cccc(c1)C(=O)Nc1cc(cc(c1C)(N+)(=O)(O))S(=O)(=O)NC1CC1
InChI=1SC18H19N3O5Sc11143513(811)18(22)1916915(1017(12(16)2)21(23)24)27(2526)20146714h358101420H67H212H3(H1922)
MFCD05860613
N(5(cyclopropylsulfamoyl)2methyl3nitrophenyl)3methylbenzamide
ZINC000004717688
ZINC04717688
ZINC4717688

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Available files

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