Vitas-M small molecule compound
2-{4-[(4-methyl-3-nitrophenyl)sulfonyl]piperazin-1-yl}-1,3-benzoxazole
Catalog ID
STK774284
SMILES [O-][N+](=O)c1cc(ccc1C)S(=O)(=O)N1CCN(CC1)c1nc2c(o1)cccc2
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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 C18H18N4O5S MW 402.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N4O5S/c1-13-6-7-14(12-16(13)22(23)24)28(25,26)21-10-8-20(9-11-21)18-19-15-4-2-3-5-17(15)27-18/h2-7,12H,8-11H2,1H3InChIKey
YMCADCGDKDMBEY-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1cc(ccc1C)S(=O)(=O)N1CCN(CC1)c1nc2c(o1)cccc2
2(4((4methyl3nitrophenyl)sulfonyl)piperazin1yl)13benzoxazole
2(4(4METHYL3NITROPHENYL)SULFONYLPIPERAZIN1YL)13BENZOXAZOLE
CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC4=CC=CC=C4O3)(N+)(=O)(O)
InChI=1SC18H18N4O5Sc1136714(1216(13)22(23)24)28(2526)2110820(91121)181915423517(15)2718h2712H811H21H3
MFCD04060517
ZINC000004602623
ZINC04602623
ZINC4602623
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