Vitas-M small molecule compound

N,N-dimethyl-4-nitro-2-[(E)-{2-[4-nitro-2-(piperidin-1-ylsulfonyl)phenyl]hydrazinylidene}methyl]aniline

Catalog ID
STK753171
SMILES CN(c1ccc(cc1/C=N/Nc1ccc(cc1S(=O)(=O)N1CCCCC1)[N+](=O)[O-])[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 C20H24N6O6S MW 476.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N6O6S/c1-23(2)19-9-7-16(25(27)28)12-15(19)14-21-22-18-8-6-17(26(29)30)13-20(18)33(31,32)24-10-4-3-5-11-24/h6-9,12-14,22H,3-5,10-11H2,1-2H3/b21-14+
InChIKey
PMPVZXMNCYWUAH-KGENOOAVSA-N
Synonyms

CN(C)C1=C(C=C(C=C1)(N+)(=O)(O))C=NNC2=C(C=C(C=C2)(N+)(=O)(O))S(=O)(=O)N3CCCCC3
CN(c1ccc(cc1C=NNc1ccc(cc1S(=O)(=O)N1CCCCC1)(N+)(=O)(O))(N+)(=O)(O))C
InChI=1SC20H24N6O6Sc123(2)199716(25(27)28)1215(19)142122188617(26(29)30)1320(18)33(3132)24104351124h69121422H351011H212H3b2114+
MFCD00469827
N((E)(2(dimethylamino)5nitrophenyl)methylideneamino)4nitro2piperidin1ylsulfonylaniline
NNDIMETHYL4NITRO2((E)(2(4NITRO2(PIPERIDIN1YLSULFONYL)PHENYL)HYDRAZINYLIDENE)METHYL)ANILINE
ZINC000015135179
ZINC33722622

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.