Vitas-M small molecule compound

3-chloro-N'-[(E)-{3-[(4-fluorophenoxy)methyl]-4-methoxyphenyl}methylidene]-1-benzothiophene-2-carbohydrazide

Catalog ID
STK723111
SMILES COc1ccc(cc1COc1ccc(cc1)F)/C=N/NC(=O)c1sc2c(c1Cl)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 C24H18ClFN2O3S MW 468.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18ClFN2O3S/c1-30-20-11-6-15(12-16(20)14-31-18-9-7-17(26)8-10-18)13-27-28-24(29)23-22(25)19-4-2-3-5-21(19)32-23/h2-13H,14H2,1H3,(H,28,29)/b27-13+
InChIKey
DKAUVTFKHWYQFF-UVHMKAGCSA-N
Synonyms

3chloroN((E)(3((4fluorophenoxy)methyl)4methoxyphenyl)methylidene)1benzothiophene2carbohydrazide
3CHLORON((E)(3((4FLUOROPHENOXY)METHYL)4METHOXYPHENYL)METHYLIDENEAMINO)1BENZOTHIOPHENE2CARBOXAMIDE
3chloroN(3((4fluorophenoxy)methyl)4methoxybenzylidene)benzo(b)thiophene2carbohydrazide
COC1=C(C=C(C=C1)C=NNC(=O)C2=C(C3=CC=CC=C3S2)Cl)COC4=CC=C(C=C4)F
COc1ccc(cc1COc1ccc(cc1)F)C=NNC(=O)c1sc2c(c1Cl)cccc2
InChI=1SC24H18ClFN2O3Sc1302011615(1216(20)1431189717(26)81018)13272824(29)2322(25)19423521(19)3223h213H14H21H3(H2829)b2713+
MFCD01852656
ZINC000002263065
ZINC33351808

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Available files

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