Vitas-M small molecule compound

N-{[2-(1,3-benzothiazol-2-yl)-4-chlorophenyl]carbamothioyl}-4-fluorobenzamide

Catalog ID
STK135308
SMILES Fc1ccc(cc1)C(=O)NC(=S)Nc1ccc(cc1c1nc2c(s1)cccc2)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 C21H13ClFN3OS2 MW 441.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13ClFN3OS2/c22-13-7-10-16(15(11-13)20-24-17-3-1-2-4-18(17)29-20)25-21(28)26-19(27)12-5-8-14(23)9-6-12/h1-11H,(H2,25,26,27,28)
InChIKey
FFTXENFLCGDHPC-UHFFFAOYSA-N
Synonyms

C1=CC=C2C(=C1)N=C(S2)C3=C(C=CC(=C3)Cl)NC(=S)NC(=O)C4=CC=C(C=C4)F
InChI=1SC21H13ClFN3OS2c221371016(15(1113)202417312418(17)2920)2521(28)2619(27)125814(23)9612h111H(H225262728)
MFCD05989274
N((2(13BENZOTHIAZOL2YL)4CHLOROPHENYL)CARBAMOTHIOYL)4FLUOROBENZAMIDE
ZINC000002851847
ZINC02851847
ZINC2851847

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Available files

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