Vitas-M small molecule compound

N'-[(E)-{3-chloro-4-[(4-fluorobenzyl)oxy]-5-methoxyphenyl}methylidene]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetohydrazide

Catalog ID
STK385560
SMILES COc1cc(/C=N/NC(=O)CSc2nnc(s2)C)cc(c1OCc1ccc(cc1)F)Cl

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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 C20H18ClFN4O3S2 MW 480.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClFN4O3S2/c1-12-24-26-20(31-12)30-11-18(27)25-23-9-14-7-16(21)19(17(8-14)28-2)29-10-13-3-5-15(22)6-4-13/h3-9H,10-11H2,1-2H3,(H,25,27)/b23-9+
InChIKey
WIUCXOICRJBUKF-NUGSKGIGSA-N
Synonyms

CC1=NN=C(S1)SCC(=O)NN=CC2=CC(=C(C(=C2)Cl)OCC3=CC=C(C=C3)F)OC
COc1cc(C=NNC(=O)CSc2nnc(s2)C)cc(c1OCc1ccc(cc1)F)Cl
InChI=1SC20H18ClFN4O3S2c112242620(3112)301118(27)2523914716(21)19(17(814)282)2910133515(22)6413h39H1011H212H3(H2527)b239+
MFCD02121480
N((1E)2(3CHLORO4((4FLUOROPHENYL)METHOXY)5METHOXYPHENYL)1AZAVINYL)2(5METHYL(134THIADIAZOL2YLTHIO))ACETAMIDE
N((E)(3CHLORO4((4FLUOROBENZYL)OXY)5METHOXYPHENYL)METHYLIDENE)2((5METHYL134THIADIAZOL2YL)SULFANYL)ACETOHYDRAZIDE
N((E)(3chloro4((4fluorophenyl)methoxy)5methoxyphenyl)methylideneamino)2((5methyl134thiadiazol2yl)sulfanyl)acetamide
ZINC000008861566
ZINC33858809

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Available files

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