Vitas-M small molecule compound

5-chloro-N-[(2-cyanophenyl)carbamothioyl]-2-methoxybenzamide

Catalog ID
STK259421
SMILES COc1ccc(cc1C(=O)NC(=S)Nc1ccccc1C#N)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 C16H12ClN3O2S MW 345.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12ClN3O2S/c1-22-14-7-6-11(17)8-12(14)15(21)20-16(23)19-13-5-3-2-4-10(13)9-18/h2-8H,1H3,(H2,19,20,21,23)
InChIKey
XQXUPPVPPHMDLJ-UHFFFAOYSA-N
Synonyms
639056-45-4
5chloroN((2cyanophenyl)carbamothioyl)2methoxybenzamide
639056454
COC1=C(C=C(C=C1)Cl)C(=O)NC(=S)NC2=CC=CC=C2C#N
InChI=1SC16H12ClN3O2Sc122147611(17)812(14)15(21)2016(23)1913532410(13)918h28H1H3(H219202123)
MFCD04096404
ZINC000000569261
ZINC00569261
ZINC569261

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Available files

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