Vitas-M small molecule compound
5-{4-[(3,4-dimethylphenyl)sulfonyl]piperazin-1-yl}-2-nitro-N-(2-phenylethyl)aniline
Catalog ID
STK171070
SMILES [O-][N+](=O)c1ccc(cc1NCCc1ccccc1)N1CCN(CC1)S(=O)(=O)c1ccc(c(c1)C)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 C26H30N4O4S MW 494.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N4O4S/c1-20-8-10-24(18-21(20)2)35(33,34)29-16-14-28(15-17-29)23-9-11-26(30(31)32)25(19-23)27-13-12-22-6-4-3-5-7-22/h3-11,18-19,27H,12-17H2,1-2H3InChIKey
HAKRNFNIWVURJB-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc(cc1NCCc1ccccc1)N1CCN(CC1)S(=O)(=O)c1ccc(c(c1)C)C
5(4((34DIMETHYLPHENYL)SULFONYL)PIPERAZIN1YL)2NITRON(2PHENYLETHYL)ANILINE
5(4(34dimethylphenyl)sulfonylpiperazin1yl)2nitroN(2phenylethyl)aniline
5(4(34DIMETHYLPHENYL)SULFONYLPIPERAZIN1YL)2NITRONPHENETHYLANILINE
CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))NCCC4=CC=CC=C4)C
InChI=1SC26H30N4O4Sc12081024(1821(20)2)35(3334)29161428(151729)2391126(30(31)32)25(1923)271312226435722h311181927H1217H212H3
MFCD04220437
ZINC000009891831
ZINC09891831
ZINC9891831
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