Vitas-M small molecule compound

dimethyl 5-[(pyridin-2-ylcarbamothioyl)amino]benzene-1,3-dicarboxylate

Catalog ID
STK164922
SMILES COC(=O)c1cc(NC(=S)Nc2ccccn2)cc(c1)C(=O)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 C16H15N3O4S MW 345.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N3O4S/c1-22-14(20)10-7-11(15(21)23-2)9-12(8-10)18-16(24)19-13-5-3-4-6-17-13/h3-9H,1-2H3,(H2,17,18,19,24)
InChIKey
FMVCSHAOJYSSOJ-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC(=CC(=C1)NC(=S)NC2=CC=CC=N2)C(=O)OC
DIMETHYL5((PYRIDIN2YLCARBAMOTHIOYL)AMINO)BENZENE13DICARBOXYLATE
DIMETHYL5(PYRIDIN2YLCARBAMOTHIOYLAMINO)BENZENE13DICARBOXYLATE
InChI=1SC16H15N3O4Sc12214(20)10711(15(21)232)912(810)1816(24)191353461713h39H12H3(H217181924)
METHYL3(METHOXYCARBONYL)5(((2PYRIDYLAMINO)THIOXOMETHYL)AMINO)BENZOATE
MFCD05991952
ZINC000000612374
ZINC00612374
ZINC612374

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Available files

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