Vitas-M small molecule compound
5-{4-[(4-bromophenyl)sulfonyl]piperazin-1-yl}-N-(furan-2-ylmethyl)-2-nitroaniline
Catalog ID
STK148796
SMILES Brc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)NCc1ccco1)[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 C21H21BrN4O5S MW 521.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21BrN4O5S/c22-16-3-6-19(7-4-16)32(29,30)25-11-9-24(10-12-25)17-5-8-21(26(27)28)20(14-17)23-15-18-2-1-13-31-18/h1-8,13-14,23H,9-12,15H2InChIKey
UXNFSZCVQBLYRJ-UHFFFAOYSA-NSynonyms
5(4((4BROMOPHENYL)SULFONYL)PIPERAZIN1YL)N(FURAN2YLMETHYL)2NITROANILINE
5(4(4BROMOPHENYL)SULFONYLPIPERAZIN1YL)N(FURAN2YLMETHYL)2NITROANILINE
Brc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)NCc1ccco1)(N+)(=O)(O)
C1CN(CCN1C2=CC(=C(C=C2)(N+)(=O)(O))NCC3=CC=CO3)S(=O)(=O)C4=CC=C(C=C4)Br
InChI=1SC21H21BrN4O5Sc22163619(7416)32(2930)2511924(101225)175821(26(27)28)20(1417)23151821133118h18131423H91215H2
MFCD02628128
ZINC000033355279
ZINC33355279
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