Vitas-M small molecule compound

ethyl 2-({[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]carbamothioyl}amino)-5-phenylthiophene-3-carboxylate

Catalog ID
STK438840
SMILES CCOC(=O)c1cc(sc1NC(=S)NCc1cn(nc1C)CC)c1ccccc1

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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 C21H24N4O2S2 MW 428.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O2S2/c1-4-25-13-16(14(3)24-25)12-22-21(28)23-19-17(20(26)27-5-2)11-18(29-19)15-9-7-6-8-10-15/h6-11,13H,4-5,12H2,1-3H3,(H2,22,23,28)
InChIKey
ZDGHWELURQWSLD-UHFFFAOYSA-N
Synonyms

CCN1C=C(C(=N1)C)CNC(=S)NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)OCC
ETHYL2(((((1ETHYL3METHYLPYRAZOL4YL)METHYL)AMINO)THIOXOMETHYL)AMINO)5PHENYLTHIOPHENE3CARBOXYLATE
ethyl2((((1ethyl3methyl1Hpyrazol4yl)methyl)carbamothioyl)amino)5phenylthiophene3carboxylate
ETHYL2((1ETHYL3METHYLPYRAZOL4YL)METHYLCARBAMOTHIOYLAMINO)5PHENYLTHIOPHENE3CARBOXYLATE
InChI=1SC21H24N4O2S2c14251316(14(3)2425)122221(28)231917(20(26)2752)1118(2919)1597681015h61113H4512H213H3(H2222328)
MFCD03945721
ZINC000017096110
ZINC17096110

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Available files

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