Vitas-M small molecule compound

ethyl 4,5-dimethyl-2-{[(pyridin-3-ylcarbonyl)carbamothioyl]amino}thiophene-3-carboxylate

Catalog ID
STK548839
SMILES CCOC(=O)c1c(NC(=S)NC(=O)c2cccnc2)sc(c1C)C

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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 C16H17N3O3S2 MW 363.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N3O3S2/c1-4-22-15(21)12-9(2)10(3)24-14(12)19-16(23)18-13(20)11-6-5-7-17-8-11/h5-8H,4H2,1-3H3,(H2,18,19,20,23)
InChIKey
AZXQKPJZIIMMPO-UHFFFAOYSA-N
Synonyms
797017-77-7
797017777
CCOC(=O)C1=C(SC(=C1C)C)NC(=S)NC(=O)C2=CN=CC=C2
ethyl45dimethyl2(((pyridin3ylcarbonyl)carbamothioyl)amino)thiophene3carboxylate
ethyl45dimethyl2(3nicotinoylthioureido)thiophene3carboxylate
ETHYL45DIMETHYL2(PYRIDINE3CARBONYLCARBAMOTHIOYLAMINO)THIOPHENE3CARBOXYLATE
InChI=1SC16H17N3O3S2c142215(21)129(2)10(3)2414(12)1916(23)1813(20)1165717811h58H4H213H3(H218192023)
MFCD01963021
ZINC000002365824
ZINC02365824
ZINC2365824

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Available files

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