Vitas-M small molecule compound

N-(2-methoxy-4-nitrophenyl)-4-(methylsulfonyl)piperazine-1-carboxamide

Catalog ID
STK461655
SMILES COc1cc(ccc1NC(=O)N1CCN(CC1)S(=O)(=O)C)[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 C13H18N4O6S MW 358.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H18N4O6S/c1-23-12-9-10(17(19)20)3-4-11(12)14-13(18)15-5-7-16(8-6-15)24(2,21)22/h3-4,9H,5-8H2,1-2H3,(H,14,18)
InChIKey
SYDHOENALMJXKM-UHFFFAOYSA-N
Synonyms

COC1=C(C=CC(=C1)(N+)(=O)(O))NC(=O)N2CCN(CC2)S(=O)(=O)C
COc1cc(ccc1NC(=O)N1CCN(CC1)S(=O)(=O)C)(N+)(=O)(O)
InChI=1SC13H18N4O6Sc12312910(17(19)20)3411(12)1413(18)155716(8615)24(221)22h349H58H212H3(H1418)
MFCD04129315
N(2METHOXY4NITROPHENYL)(4(METHYLSULFONYL)PIPERAZINYL)CARBOXAMIDE
N(2methoxy4nitrophenyl)4(methylsulfonyl)piperazine1carboxamide
N(2METHOXY4NITROPHENYL)4METHYLSULFONYLPIPERAZINE1CARBOXAMIDE
ZINC000016346384
ZINC16346384

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Available files

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