Vitas-M small molecule compound

N-{2-[(4-iodobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-methylbenzamide

Catalog ID
STK759008
SMILES Ic1ccc(cc1)CSc1nc2c(s1)cc(cc2)NC(=O)c1ccccc1C

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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 C22H17IN2OS2 MW 516.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17IN2OS2/c1-14-4-2-3-5-18(14)21(26)24-17-10-11-19-20(12-17)28-22(25-19)27-13-15-6-8-16(23)9-7-15/h2-12H,13H2,1H3,(H,24,26)
InChIKey
ZHRHRAFJIFXWIE-UHFFFAOYSA-N
Synonyms

CC1=CC=CC=C1C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC4=CC=C(C=C4)I
InChI=1SC22H17IN2OS2c114423518(14)21(26)241710111920(1217)2822(2519)2713156816(23)9715h212H13H21H3(H2426)
MFCD01234885
N(2((4iodobenzyl)sulfanyl)13benzothiazol6yl)2methylbenzamide
N(2((4IODOPHENYL)METHYLSULFANYL)13BENZOTHIAZOL6YL)2METHYLBENZAMIDE
ZINC000003667280
ZINC03667280
ZINC3667280

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Available files

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