Vitas-M small molecule compound

3-methyl-N-(2,2,2-trichloro-1-{[(2-chlorophenyl)carbamothioyl]amino}ethyl)benzamide

Catalog ID
STK808541
SMILES S=C(NC(C(Cl)(Cl)Cl)NC(=O)c1cccc(c1)C)Nc1ccccc1Cl

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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 C17H15Cl4N3OS MW 451.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15Cl4N3OS/c1-10-5-4-6-11(9-10)14(25)23-15(17(19,20)21)24-16(26)22-13-8-3-2-7-12(13)18/h2-9,15H,1H3,(H,23,25)(H2,22,24,26)
InChIKey
WPGXZOBQXULCKO-UHFFFAOYSA-N
Synonyms

3methylN(222trichloro1(((2chlorophenyl)carbamothioyl)amino)ethyl)benzamide
3METHYLN(222TRICHLORO1((2CHLOROPHENYL)CARBAMOTHIOYLAMINO)ETHYL)BENZAMIDE
3METHYLN(222TRICHLORO1(3(2CHLOROPHENYL)THIOUREIDO)ETHYL)BENZAMIDE
CC1=CC=CC(=C1)C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=CC=CC=C2Cl
InChI=1SC17H15Cl4N3OSc11054611(910)14(25)2315(17(1920)21)2416(26)2213832712(13)18h2915H1H3(H2325)(H2222426)
MFCD00266244
ZINC000000836701
ZINC000000836702

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Available files

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