Vitas-M small molecule compound

5-{4-[(4-bromophenyl)sulfonyl]piperazin-1-yl}-N-(2-methylpropyl)-2-nitroaniline

Catalog ID
STK205905
SMILES CC(CNc1cc(ccc1[N+](=O)[O-])N1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br)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 C20H25BrN4O4S MW 497.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25BrN4O4S/c1-15(2)14-22-19-13-17(5-8-20(19)25(26)27)23-9-11-24(12-10-23)30(28,29)18-6-3-16(21)4-7-18/h3-8,13,15,22H,9-12,14H2,1-2H3
InChIKey
QXJYFXMMVWIZSD-UHFFFAOYSA-N
Synonyms

5(4((4BROMOPHENYL)SULFONYL)PIPERAZIN1YL)N(2METHYLPROPYL)2NITROANILINE
5(4(4BROMOPHENYL)SULFONYLPIPERAZIN1YL)N(2METHYLPROPYL)2NITROANILINE
CC(C)CNC1=C(C=CC(=C1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br)(N+)(=O)(O)
CC(CNc1cc(ccc1(N+)(=O)(O))N1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br)C
InChI=1SC20H25BrN4O4Sc115(2)1422191317(5820(19)25(26)27)2391124(121023)30(2829)186316(21)4718h38131522H91214H212H3
MFCD06154931
ZINC000009971697
ZINC09971697
ZINC9971697

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Available files

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