Vitas-M small molecule compound

2-(1,3-benzothiazol-2-ylsulfanyl)-1-(4-methylphenyl)ethanone

Catalog ID
STK208303
SMILES Cc1ccc(cc1)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 C16H13NOS2 MW 299.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13NOS2/c1-11-6-8-12(9-7-11)14(18)10-19-16-17-13-4-2-3-5-15(13)20-16/h2-9H,10H2,1H3
InChIKey
QNOVHTCEUMTCDF-UHFFFAOYSA-N
Synonyms
23384-64-7
2(13BENZOTHIAZOL2YLSULFANYL)1(4METHYLPHENYL)ETHANONE
2(BENZO(D)THIAZOL2YLTHIO)1(PTOLYL)ETHANONE
2(PTOLUOYLMETHYLTHIO)BENZOTHIAZOLE
23384647
2BENZOTHIAZOL2YLTHIO1(4METHYLPHENYL)ETHAN1ONE
CC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3S2
ETHANONE2(2BENZOTHIAZOLYLTHIO)1(4METHYLPHENYL)
ETHANONE2(BENZOTHIAZOL2YLTHIO)1(4TOLYL)
InChI=1SC16H13NOS2c1116812(9711)14(18)1019161713423515(13)2016h29H10H21H3
MFCD00845501
ZINC000000281341
ZINC00281341
ZINC281341

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Available files

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