Vitas-M small molecule compound

N-(2,2,2-trichloro-1-{[(3-hydroxyphenyl)carbamothioyl]amino}ethyl)propanamide

Catalog ID
STK808570
SMILES CCC(=O)NC(C(Cl)(Cl)Cl)NC(=S)Nc1cccc(c1)O

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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 C12H14Cl3N3O2S MW 370.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14Cl3N3O2S/c1-2-9(20)17-10(12(13,14)15)18-11(21)16-7-4-3-5-8(19)6-7/h3-6,10,19H,2H2,1H3,(H,17,20)(H2,16,18,21)
InChIKey
LPIAISLXGLKYIC-UHFFFAOYSA-N
Synonyms

CCC(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC1=CC(=CC=C1)O
InChI=1SC12H14Cl3N3O2Sc129(20)1710(12(1314)15)1811(21)1674358(19)67h361019H2H21H3(H1720)(H2161821)
MFCD00412268
N(222trichloro1(((3hydroxyphenyl)carbamothioyl)amino)ethyl)propanamide
N(222TRICHLORO1((3HYDROXYPHENYL)CARBAMOTHIOYLAMINO)ETHYL)PROPANAMIDE
ZINC000002706990
ZINC000002706992

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Available files

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