Vitas-M small molecule compound

[4-(benzylsulfonyl)-6-nitro-1-phenyl-1H-indazol-3-yl](piperidin-1-yl)methanone

Catalog ID
STK770401
SMILES O=C(c1nn(c2c1c(cc(c2)[N+](=O)[O-])S(=O)(=O)Cc1ccccc1)c1ccccc1)N1CCCCC1

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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 C26H24N4O5S MW 504.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N4O5S/c31-26(28-14-8-3-9-15-28)25-24-22(29(27-25)20-12-6-2-7-13-20)16-21(30(32)33)17-23(24)36(34,35)18-19-10-4-1-5-11-19/h1-2,4-7,10-13,16-17H,3,8-9,14-15,18H2
InChIKey
DYYXOURNGFKZSV-UHFFFAOYSA-N
Synonyms
(4(benzylsulfonyl)6nitro1phenyl1Hindazol3yl)(piperidin1yl)methanone
(4BENZYLSULFONYL6NITRO1PHENYLINDAZOL3YL)PIPERIDIN1YLMETHANONE
C1CCN(CC1)C(=O)C2=NN(C3=CC(=CC(=C32)S(=O)(=O)CC4=CC=CC=C4)(N+)(=O)(O))C5=CC=CC=C5
O=C(c1nn(c2c1c(cc(c2)(N+)(=O)(O))S(=O)(=O)Cc1ccccc1)c1ccccc1)N1CCCCC1
Registry IDs
MFCD03766096
ZINC000001072824
ZINC01072824
ZINC1072824

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Available files

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