Vitas-M small molecule compound

2-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamothioyl)-4-fluorobenzamide

Catalog ID
STK243920
SMILES S=C(NC(=O)c1ccc(cc1Cl)F)Nc1ccc2c(c1)OCCO2

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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 C16H12ClFN2O3S MW 366.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12ClFN2O3S/c17-12-7-9(18)1-3-11(12)15(21)20-16(24)19-10-2-4-13-14(8-10)23-6-5-22-13/h1-4,7-8H,5-6H2,(H2,19,20,21,24)
InChIKey
ZHMVWRYCYWUSAP-UHFFFAOYSA-N
Synonyms

2chloroN(23dihydro14benzodioxin6ylcarbamothioyl)4fluorobenzamide
C1COC2=C(O1)C=CC(=C2)NC(=S)NC(=O)C3=C(C=C(C=C3)F)Cl
InChI=1SC16H12ClFN2O3Sc171279(18)1311(12)15(21)2016(24)1910241314(810)23652213h1478H56H2(H219202124)
MFCD03909552
N(2CHLORO4FLUOROBENZOYL)N(23DIHYDRO14BENZODIOXIN6YL)THIOUREA
ZINC000000724914
ZINC00724914
ZINC724914

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Available files

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