Vitas-M small molecule compound

1-(2-methoxyphenyl)-4-[(4-methyl-3-nitrophenyl)sulfonyl]piperazine

Catalog ID
STL197613
SMILES COc1ccccc1N1CCN(CC1)S(=O)(=O)c1ccc(c(c1)[N+](=O)[O-])C

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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 C18H21N3O5S MW 391.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N3O5S/c1-14-7-8-15(13-17(14)21(22)23)27(24,25)20-11-9-19(10-12-20)16-5-3-4-6-18(16)26-2/h3-8,13H,9-12H2,1-2H3
InChIKey
MUQDGNNJYGEFCH-UHFFFAOYSA-N
Synonyms

1(2methoxyphenyl)4((4methyl3nitrophenyl)sulfonyl)piperazine
1(2METHOXYPHENYL)4(4METHYL3NITROBENZENESULFONYL)PIPERAZINE
1(2METHOXYPHENYL)4(4METHYL3NITROPHENYL)SULFONYLPIPERAZINE
4((4(2METHOXYPHENYL)PIPERAZINYL)SULFONYL)1METHYL2NITROBENZENE
CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3OC)(N+)(=O)(O)
COc1ccccc1N1CCN(CC1)S(=O)(=O)c1ccc(c(c1)(N+)(=O)(O))C
InChI=1SC18H21N3O5Sc1147815(1317(14)21(22)23)27(2425)2011919(101220)16534618(16)262h3813H912H212H3
MFCD01154427
ZINC000004798243
ZINC04798243
ZINC4798243

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Available files

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