Vitas-M small molecule compound

N-cyclopropyl-5-[4-(ethylsulfonyl)piperazin-1-yl]-2-nitroaniline

Catalog ID
STK148812
SMILES CCS(=O)(=O)N1CCN(CC1)c1ccc(c(c1)NC1CC1)[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 C15H22N4O4S MW 354.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H22N4O4S/c1-2-24(22,23)18-9-7-17(8-10-18)13-5-6-15(19(20)21)14(11-13)16-12-3-4-12/h5-6,11-12,16H,2-4,7-10H2,1H3
InChIKey
MHHWNXFULUHPMR-UHFFFAOYSA-N
Synonyms

CCS(=O)(=O)N1CCN(CC1)c1ccc(c(c1)NC1CC1)(N+)(=O)(O)
CCS(=O)(=O)N1CCN(CC1)C2=CC(=C(C=C2)(N+)(=O)(O))NC3CC3
InChI=1SC15H22N4O4Sc1224(2223)189717(81018)135615(19(20)21)14(1113)16123412h56111216H24710H21H3
MFCD02629887
NCYCLOPROPYL5(4(ETHYLSULFONYL)PIPERAZIN1YL)2NITROANILINE
NCYCLOPROPYL5(4ETHYLSULFONYLPIPERAZIN1YL)2NITROANILINE
ZINC000004117514
ZINC04117514
ZINC4117514

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Available files

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