Vitas-M small molecule compound

5-[4-(naphthalen-2-ylsulfonyl)piperazin-1-yl]-2-nitro-N-(1-phenylethyl)aniline

Catalog ID
STK148803
SMILES CC(c1ccccc1)Nc1cc(ccc1[N+](=O)[O-])N1CCN(CC1)S(=O)(=O)c1ccc2c(c1)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 C28H28N4O4S MW 516.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N4O4S/c1-21(22-7-3-2-4-8-22)29-27-20-25(12-14-28(27)32(33)34)30-15-17-31(18-16-30)37(35,36)26-13-11-23-9-5-6-10-24(23)19-26/h2-14,19-21,29H,15-18H2,1H3
InChIKey
ZMXHFIWEYLGTRJ-UHFFFAOYSA-N
Synonyms

5(4(NAPHTHALEN2YLSULFONYL)PIPERAZIN1YL)2NITRON(1PHENYLETHYL)ANILINE
5(4NAPHTHALEN2YLSULFONYLPIPERAZIN1YL)2NITRON(1PHENYLETHYL)ANILINE
CC(C1=CC=CC=C1)NC2=C(C=CC(=C2)N3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4)(N+)(=O)(O)
CC(c1ccccc1)Nc1cc(ccc1(N+)(=O)(O))N1CCN(CC1)S(=O)(=O)c1ccc2c(c1)cccc2
InChI=1SC28H28N4O4Sc121(227324822)29272025(121428(27)32(33)34)30151731(181630)37(3536)261311239561024(23)1926h214192129H1518H21H3
MFCD02629878
ZINC000009601712
ZINC000009601713

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Available files

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