Vitas-M small molecule compound

ethyl 4-[(1,3-benzothiazol-2-ylsulfanyl)methyl]benzoate

Catalog ID
STK219527
SMILES CCOC(=O)c1ccc(cc1)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 C17H15NO2S2 MW 329.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15NO2S2/c1-2-20-16(19)13-9-7-12(8-10-13)11-21-17-18-14-5-3-4-6-15(14)22-17/h3-10H,2,11H2,1H3
InChIKey
QMORCBZMSNMMBU-UHFFFAOYSA-N
Synonyms
879025-50-0
879025500
CCOC(=O)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3S2
ETHYL4((13BENZOTHIAZOL2YLSULFANYL)METHYL)BENZOATE
ETHYL4(13BENZOTHIAZOL2YLSULFANYLMETHYL)BENZOATE
InChI=1SC17H15NO2S2c122016(19)139712(81013)1121171814534615(14)2217h310H211H21H3
MFCD07437750
ZINC000004814905
ZINC04814905
ZINC4814905

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Available files

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