Vitas-M small molecule compound

N-[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-methoxy-3-methylbenzamide

Catalog ID
STK519713
SMILES COc1c(C)cccc1C(=O)Nc1cc(ccc1Cl)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 C22H17ClN2O2S MW 408.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17ClN2O2S/c1-13-6-5-7-15(20(13)27-2)21(26)24-18-12-14(10-11-16(18)23)22-25-17-8-3-4-9-19(17)28-22/h3-12H,1-2H3,(H,24,26)
InChIKey
MFUOELJEPMDQFZ-UHFFFAOYSA-N
Synonyms

CC1=CC=CC(=C1OC)C(=O)NC2=C(C=CC(=C2)C3=NC4=CC=CC=C4S3)Cl
InChI=1SC22H17ClN2O2Sc11365715(20(13)272)21(26)24181214(101116(18)23)222517834919(17)2822h312H12H3(H2426)
MFCD05850234
N(5(13benzothiazol2yl)2chlorophenyl)2methoxy3methylbenzamide
ZINC000002891023
ZINC02891023
ZINC2891023

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Available files

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