Vitas-M small molecule compound

N-cyclohexyl-3-[(2E)-1-(1,1-dioxido-1,2-benzothiazol-3-yl)-2-(4-ethoxybenzylidene)hydrazinyl]propanamide

Catalog ID
STK044763
SMILES CCOc1ccc(cc1)/C=N/N(C1=NS(=O)(=O)c2c1cccc2)CCC(=O)NC1CCCCC1

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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 C25H30N4O4S MW 482.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N4O4S/c1-2-33-21-14-12-19(13-15-21)18-26-29(17-16-24(30)27-20-8-4-3-5-9-20)25-22-10-6-7-11-23(22)34(31,32)28-25/h6-7,10-15,18,20H,2-5,8-9,16-17H2,1H3,(H,27,30)/b26-18+
InChIKey
FLRAQUCXRDSKDE-NLRVBDNBSA-N
Synonyms

CCOC1=CC=C(C=C1)C=NN(CCC(=O)NC2CCCCC2)C3=NS(=O)(=O)C4=CC=CC=C43
CCOc1ccc(cc1)C=NN(C1=NS(=O)(=O)c2c1cccc2)CCC(=O)NC1CCCCC1
InChI=1SC25H30N4O4Sc123321141219(131521)182629(171624(30)27208435920)252210671123(22)34(3132)2825h6710151820H25891617H21H3(H2730)b2618+
MFCD03215115
Ncyclohexyl3((11dioxo12benzothiazol3yl)((E)(4ethoxyphenyl)methylideneamino)amino)propanamide
NCYCLOHEXYL3((2E)1(11DIOXIDO12BENZOTHIAZOL3YL)2(4ETHOXYBENZYLIDENE)HYDRAZINYL)PROPANAMIDE
STK044763
ZINC000009425702
ZINC34707157

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Available files

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