Vitas-M small molecule compound

2-methyl-N-(2,2,2-trichloro-1-{[(2,5-dichlorophenyl)carbamothioyl]amino}ethyl)benzamide

Catalog ID
STK808454
SMILES S=C(NC(C(Cl)(Cl)Cl)NC(=O)c1ccccc1C)Nc1cc(Cl)ccc1Cl

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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 C17H14Cl5N3OS MW 485.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14Cl5N3OS/c1-9-4-2-3-5-11(9)14(26)24-15(17(20,21)22)25-16(27)23-13-8-10(18)6-7-12(13)19/h2-8,15H,1H3,(H,24,26)(H2,23,25,27)
InChIKey
MRPCHWDCEGFFQP-UHFFFAOYSA-N
Synonyms

2methylN(222trichloro1(((25dichlorophenyl)carbamothioyl)amino)ethyl)benzamide
2METHYLN(222TRICHLORO1((25DICHLOROPHENYL)CARBAMOTHIOYLAMINO)ETHYL)BENZAMIDE
CC1=CC=CC=C1C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=C(C=CC(=C2)Cl)Cl
InChI=1SC17H14Cl5N3OSc19423511(9)14(26)2415(17(2021)22)2516(27)2313810(18)6712(13)19h2815H1H3(H2426)(H2232527)
MFCD00268302
ZINC000003137332
ZINC000003137333

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Available files

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