Vitas-M small molecule compound

methyl 3-{(E)-[2-(1,1-dioxido-1,2-benzothiazol-3-yl)-2-methylhydrazinylidene]methyl}-4-hydroxybenzoate

Catalog ID
STK180028
SMILES COC(=O)c1ccc(c(c1)/C=N/N(C1=NS(=O)(=O)c2c1cccc2)C)O

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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 C17H15N3O5S MW 373.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N3O5S/c1-20(16-13-5-3-4-6-15(13)26(23,24)19-16)18-10-12-9-11(17(22)25-2)7-8-14(12)21/h3-10,21H,1-2H3/b18-10+
InChIKey
SIXDQUQUJPMYOF-VCHYOVAHSA-N
Synonyms

COC(=O)c1ccc(c(c1)C=NN(C1=NS(=O)(=O)c2c1cccc2)C)O
methyl3((E)(2(11dioxido12benzothiazol3yl)2methylhydrazinylidene)methyl)4hydroxybenzoate
MFCD04084629
ZINC000004705161

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Available files

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