Vitas-M small molecule compound

1-[(4-chlorophenyl)sulfonyl]-4-[4-nitro-3-(pyrrolidin-1-yl)phenyl]piperazine

Catalog ID
STK028811
SMILES Clc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)N1CCCC1)[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 C20H23ClN4O4S MW 450.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23ClN4O4S/c21-16-3-6-18(7-4-16)30(28,29)24-13-11-22(12-14-24)17-5-8-19(25(26)27)20(15-17)23-9-1-2-10-23/h3-8,15H,1-2,9-14H2
InChIKey
CJUCGZULFDPBFM-UHFFFAOYSA-N
Synonyms

1((4CHLOROPHENYL)SULFONYL)4(4NITRO3(PYRROLIDIN1YL)PHENYL)PIPERAZINE
1(4CHLOROPHENYL)SULFONYL4(4NITRO3PYRROLIDIN1YLPHENYL)PIPERAZINE
4CHLORO1((4(4NITRO3PYRROLIDINYLPHENYL)PIPERAZINYL)SULFONYL)BENZENE
C1CCN(C1)C2=C(C=CC(=C2)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl)(N+)(=O)(O)
Clc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)N1CCCC1)(N+)(=O)(O)
InChI=1SC20H23ClN4O4Sc21163618(7416)30(2829)24131122(121424)175819(25(26)27)20(1517)239121023h3815H12914H2
MFCD02222028
STK028811
ZINC000008741295
ZINC08741295
ZINC8741295

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Available files

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