Vitas-M small molecule compound
1-(5-chloro-2-methylphenyl)-4-[(4-nitrophenyl)sulfonyl]piperazine
Catalog ID
STL113804
SMILES Clc1ccc(c(c1)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)[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 C17H18ClN3O4S MW 395.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18ClN3O4S/c1-13-2-3-14(18)12-17(13)19-8-10-20(11-9-19)26(24,25)16-6-4-15(5-7-16)21(22)23/h2-7,12H,8-11H2,1H3InChIKey
KGSSEVTXHIRACQ-UHFFFAOYSA-NSynonyms
1(5chloro2methylphenyl)4((4nitrophenyl)sulfonyl)piperazine
1(5CHLORO2METHYLPHENYL)4(4NITROPHENYL)SULFONYLPIPERAZINE
CC1=C(C=C(C=C1)Cl)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)(N+)(=O)(O)
Clc1ccc(c(c1)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)(N+)(=O)(O))C
InChI=1SC17H18ClN3O4Sc1132314(18)1217(13)1981020(11919)26(2425)166415(5716)21(22)23h2712H811H21H3
MFCD05086302
ZINC000001079728
ZINC01079728
ZINC1079728
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