Vitas-M small molecule compound

methyl 2-[(1,2,3-benzothiadiazol-6-ylcarbonyl)amino]-4,5-dimethoxybenzoate

Catalog ID
STL018264
SMILES COC(=O)c1cc(OC)c(cc1NC(=O)c1ccc2c(c1)snn2)OC

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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/c1-23-13-7-10(17(22)25-3)12(8-14(13)24-2)18-16(21)9-4-5-11-15(6-9)26-20-19-11/h4-8H,1-3H3,(H,18,21)
InChIKey
XRVOGQZTIJXICD-UHFFFAOYSA-N
Synonyms

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)C2=CC3=C(C=C2)N=NS3)OC
InChI=1SC17H15N3O5Sc12313710(17(22)253)12(814(13)242)1816(21)9451115(69)26201911h48H13H3(H1821)
methyl2((123benzothiadiazol6ylcarbonyl)amino)45dimethoxybenzoate
methyl2(123benzothiadiazole6carbonylamino)45dimethoxybenzoate
METHYL2(BENZO(D)123THIADIAZOL6YLCARBONYLAMINO)45DIMETHOXYBENZOATE
MFCD10082226
ZINC000012274821
ZINC12274821

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Available files

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