Vitas-M small molecule compound

(2E)-N-[(2-chlorophenyl)carbamothioyl]-3-(4-fluorophenyl)prop-2-enamide

Catalog ID
STK864300
SMILES S=C(Nc1ccccc1Cl)NC(=O)/C=C/c1ccc(cc1)F

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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 C16H12ClFN2OS MW 334.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12ClFN2OS/c17-13-3-1-2-4-14(13)19-16(22)20-15(21)10-7-11-5-8-12(18)9-6-11/h1-10H,(H2,19,20,21,22)/b10-7+
InChIKey
WYPBZWTVZZGYDM-JXMROGBWSA-N
Synonyms
412963-94-1
(2E)N((2chlorophenyl)carbamothioyl)3(4fluorophenyl)prop2enamide
(E)N((2chlorophenyl)carbamothioyl)3(4fluorophenyl)acrylamide
(E)N((2CHLOROPHENYL)CARBAMOTHIOYL)3(4FLUOROPHENYL)PROP2ENAMIDE
412963941
C1=CC=C(C(=C1)NC(=S)NC(=O)C=CC2=CC=C(C=C2)F)Cl
InChI=1SC16H12ClFN2OSc1713312414(13)1916(22)2015(21)107115812(18)9611h110H(H219202122)b107+
MFCD00401884
S=C(Nc1ccccc1Cl)NC(=O)C=Cc1ccc(cc1)F
ZINC000000284367
ZINC00284367
ZINC284367

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Available files

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