Vitas-M small molecule compound

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

Catalog ID
STK255257
SMILES S=C(NC(=O)c1cccc(c1Cl)Cl)Nc1ccc(c(c1)Cl)c1nc2c(s1)cccc2

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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 C21H12Cl3N3OS2 MW 492.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H12Cl3N3OS2/c22-14-5-3-4-13(18(14)24)19(28)27-21(29)25-11-8-9-12(15(23)10-11)20-26-16-6-1-2-7-17(16)30-20/h1-10H,(H2,25,27,28,29)
InChIKey
JNEVFYJNVCKSJP-UHFFFAOYSA-N
Synonyms

C1=CC=C2C(=C1)N=C(S2)C3=C(C=C(C=C3)NC(=S)NC(=O)C4=C(C(=CC=C4)Cl)Cl)Cl
InChI=1SC21H12Cl3N3OS2c221453413(18(14)24)19(28)2721(29)25118912(15(23)1011)202616612717(16)3020h110H(H225272829)
MFCD04074847
N((4(13benzothiazol2yl)3chlorophenyl)carbamothioyl)23dichlorobenzamide
ZINC000002593112
ZINC02593112
ZINC2593112

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Available files

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