Vitas-M small molecule compound

methyl 2-{[(2-ethoxy-2-oxoethyl)carbamothioyl]amino}-5-methyl-4-phenylthiophene-3-carboxylate

Catalog ID
STK468375
SMILES CCOC(=O)CNC(=S)Nc1sc(c(c1C(=O)OC)c1ccccc1)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 C18H20N2O4S2 MW 392.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O4S2/c1-4-24-13(21)10-19-18(25)20-16-15(17(22)23-3)14(11(2)26-16)12-8-6-5-7-9-12/h5-9H,4,10H2,1-3H3,(H2,19,20,25)
InChIKey
BEGDANFXRJPAGG-UHFFFAOYSA-N
Synonyms

CCOC(=O)CNC(=S)NC1=C(C(=C(S1)C)C2=CC=CC=C2)C(=O)OC
ETHYL2((((3(METHOXYCARBONYL)5METHYL4PHENYL(2THIENYL))AMINO)THIOXOMETHYL)AMINO)ACETATE
InChI=1SC18H20N2O4S2c142413(21)101918(25)201615(17(22)233)14(11(2)2616)128657912h59H410H213H3(H2192025)
methyl2(((2ethoxy2oxoethyl)carbamothioyl)amino)5methyl4phenylthiophene3carboxylate
methyl2((2ethoxy2oxoethyl)carbamothioylamino)5methyl4phenylthiophene3carboxylate
MFCD07047358
ZINC000017080196
ZINC17080196

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Available files

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