Vitas-M small molecule compound

2-(1,3-benzothiazol-2-ylsulfanyl)-1-(2,2,4,6,7-pentamethylquinolin-1(2H)-yl)ethanone

Catalog ID
STK320632
SMILES CC1=CC(C)(C)N(c2c1cc(C)c(c2)C)C(=O)CSc1nc2c(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 C23H24N2OS2 MW 408.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N2OS2/c1-14-10-17-16(3)12-23(4,5)25(19(17)11-15(14)2)21(26)13-27-22-24-18-8-6-7-9-20(18)28-22/h6-12H,13H2,1-5H3
InChIKey
VTFACDJHXVSVTL-UHFFFAOYSA-N
Synonyms

2(13benzothiazol2ylsulfanyl)1(22467pentamethylquinolin1(2H)yl)ethanone
2(13benzothiazol2ylsulfanyl)1(22467pentamethylquinolin1yl)ethanone
2(benzo(d)thiazol2ylthio)1(22467pentamethylquinolin1(2H)yl)ethanone
CC1=C(C=C2C(=C1)C(=CC(N2C(=O)CSC3=NC4=CC=CC=C4S3)(C)C)C)C
InChI=1SC23H24N2OS2c114101716(3)1223(45)25(19(17)1115(14)2)21(26)1327222418867920(18)2822h612H13H215H3
MFCD01958713
ZINC000004371538
ZINC04371538
ZINC4371538

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Available files

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