Vitas-M small molecule compound

2-nitro-5-{4-[(2-nitrophenyl)sulfonyl]piperazin-1-yl}-N-(prop-2-en-1-yl)aniline

Catalog ID
STK206077
SMILES C=CCNc1cc(ccc1[N+](=O)[O-])N1CCN(CC1)S(=O)(=O)c1ccccc1[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 C19H21N5O6S MW 447.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N5O6S/c1-2-9-20-16-14-15(7-8-17(16)23(25)26)21-10-12-22(13-11-21)31(29,30)19-6-4-3-5-18(19)24(27)28/h2-8,14,20H,1,9-13H2
InChIKey
DTZZFZLMFOBJTI-UHFFFAOYSA-N
Synonyms

2NITRO5(4((2NITROPHENYL)SULFONYL)PIPERAZIN1YL)N(PROP2EN1YL)ANILINE
2nitro5(4(2nitrophenyl)sulfonylpiperazin1yl)Nprop2enylaniline
C=CCNC1=C(C=CC(=C1)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3(N+)(=O)(O))(N+)(=O)(O)
C=CCNc1cc(ccc1(N+)(=O)(O))N1CCN(CC1)S(=O)(=O)c1ccccc1(N+)(=O)(O)
InChI=1SC19H21N5O6Sc12920161415(7817(16)23(25)26)21101222(131121)31(2930)19643518(19)24(27)28h281420H1913H2
MFCD06666781
ZINC000009971868
ZINC09971868
ZINC9971868

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Available files

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