Vitas-M small molecule compound

5-[(chloroacetyl)amino]-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide

Catalog ID
STK483405
SMILES CCN(C(=O)c1sc(c(c1C)C#N)NC(=O)CCl)CC

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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 C13H16ClN3O2S MW 313.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16ClN3O2S/c1-4-17(5-2)13(19)11-8(3)9(7-15)12(20-11)16-10(18)6-14/h4-6H2,1-3H3,(H,16,18)
InChIKey
SWPRIXPIZXWJPF-UHFFFAOYSA-N
Synonyms
540793-27-9
5((2CHLOROACETYL)AMINO)4CYANONNDIETHYL3METHYLTHIOPHENE2CARBOXAMIDE
5((chloroacetyl)amino)4cyanoNNdiethyl3methylthiophene2carboxamide
5(2CHLOROACETAMIDO)4CYANONNDIETHYL3METHYLTHIOPHENE2CARBOXAMIDE
540793279
CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)CCl)C#N)C
InChI=1SC13H16ClN3O2Sc1417(52)13(19)118(3)9(715)12(2011)1610(18)614h46H213H3(H1618)
MFCD03363526
N(5(NNDIETHYLCARBAMOYL)3CYANO4METHYL(2THIENYL))2CHLOROACETAMIDE
ZINC000006046278
ZINC06046278
ZINC6046278

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Available files

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