Vitas-M small molecule compound

1-methyl-4-[(2-methyl-5-nitrophenyl)sulfonyl]piperazine

Catalog ID
STL302564
SMILES CN1CCN(CC1)S(=O)(=O)c1cc(ccc1C)[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 C12H17N3O4S MW 299.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H17N3O4S/c1-10-3-4-11(15(16)17)9-12(10)20(18,19)14-7-5-13(2)6-8-14/h3-4,9H,5-8H2,1-2H3
InChIKey
NDVWWGAQHOJDQB-UHFFFAOYSA-N
Synonyms
325809-67-4
1METHYL2((4METHYLPIPERAZINYL)SULFONYL)4NITROBENZENE
1methyl4((2methyl5nitrophenyl)sulfonyl)piperazine
1METHYL4(2METHYL5NITROBENZENESULFONYL)PIPERAZINE
1METHYL4(2METHYL5NITROPHENYL)SULFONYLPIPERAZINE
325809674
CC1=C(C=C(C=C1)(N+)(=O)(O))S(=O)(=O)N2CCN(CC2)C
CN1CCN(CC1)S(=O)(=O)c1cc(ccc1C)(N+)(=O)(O)
InChI=1SC12H17N3O4Sc1103411(15(16)17)912(10)20(1819)147513(2)6814h349H58H212H3
MFCD02043680
ZINC000035993518
ZINC35993518

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Available files

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