Vitas-M small molecule compound

N-[4-({[(4-chloro-2-methoxyphenoxy)acetyl]carbamothioyl}amino)-2-methoxyphenyl]-2-methylpropanamide

Catalog ID
STK234477
SMILES COc1cc(ccc1NC(=O)C(C)C)NC(=S)NC(=O)COc1ccc(cc1OC)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 C21H24ClN3O5S MW 465.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24ClN3O5S/c1-12(2)20(27)24-15-7-6-14(10-17(15)28-3)23-21(31)25-19(26)11-30-16-8-5-13(22)9-18(16)29-4/h5-10,12H,11H2,1-4H3,(H,24,27)(H2,23,25,26,31)
InChIKey
JAVXILDTDJFPJB-UHFFFAOYSA-N
Synonyms

CC(C)C(=O)NC1=C(C=C(C=C1)NC(=S)NC(=O)COC2=C(C=C(C=C2)Cl)OC)OC
InChI=1SC21H24ClN3O5Sc112(2)20(27)24157614(1017(15)283)2321(31)2519(26)1130168513(22)918(16)294h51012H11H214H3(H2427)(H223252631)
MFCD03906722
N(4((((4chloro2methoxyphenoxy)acetyl)carbamothioyl)amino)2methoxyphenyl)2methylpropanamide
N(4((2(4CHLORO2METHOXYPHENOXY)ACETYL)CARBAMOTHIOYLAMINO)2METHOXYPHENYL)2METHYLPROPANAMIDE
ZINC000005944550
ZINC05944550
ZINC5944550

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Available files

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