Vitas-M small molecule compound

N'-{(E)-[1-(2-chloro-6-fluorobenzyl)-1H-indol-3-yl]methylidene}-1-(ethylsulfonyl)piperidine-3-carbohydrazide

Catalog ID
STK479907
SMILES CCS(=O)(=O)N1CCCC(C1)C(=O)N/N=C/c1cn(c2c1cccc2)Cc1c(F)cccc1Cl

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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 C24H26ClFN4O3S MW 505.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26ClFN4O3S/c1-2-34(32,33)30-12-6-7-17(15-30)24(31)28-27-13-18-14-29(23-11-4-3-8-19(18)23)16-20-21(25)9-5-10-22(20)26/h3-5,8-11,13-14,17H,2,6-7,12,15-16H2,1H3,(H,28,31)/b27-13+
InChIKey
OGOCYNAENMWLAV-UVHMKAGCSA-N
Synonyms

CCS(=O)(=O)N1CCCC(C1)C(=O)NN=Cc1cn(c2c1cccc2)Cc1c(F)cccc1Cl
CCS(=O)(=O)N1CCCC(C1)C(=O)NN=CC2=CN(C3=CC=CC=C32)CC4=C(C=CC=C4Cl)F
InChI=1SC24H26ClFN4O3Sc1234(3233)30126717(1530)24(31)282713181429(231143819(18)23)162021(25)951022(20)26h35811131417H267121516H21H3(H2831)b2713+
MFCD08098139
N((E)(1((2chloro6fluorophenyl)methyl)indol3yl)methylideneamino)1ethylsulfonylpiperidine3carboxamide
N((E)(1(2chloro6fluorobenzyl)1Hindol3yl)methylidene)1(ethylsulfonyl)piperidine3carbohydrazide
ZINC000013320772
ZINC000013320775

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Available files

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