Vitas-M small molecule compound

4-cyano-N,N,3-trimethyl-5-{[(4-nitrophenoxy)acetyl]amino}thiophene-2-carboxamide

Catalog ID
STK420114
SMILES N#Cc1c(NC(=O)COc2ccc(cc2)[N+](=O)[O-])sc(c1C)C(=O)N(C)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 C17H16N4O5S MW 388.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N4O5S/c1-10-13(8-18)16(27-15(10)17(23)20(2)3)19-14(22)9-26-12-6-4-11(5-7-12)21(24)25/h4-7H,9H2,1-3H3,(H,19,22)
InChIKey
WDGNSEZBJIWBRO-UHFFFAOYSA-N
Synonyms
514818-03-2
4CYANO5(((4NITROPHENOXY)ACETYL)AMINO)NN3TRIMETHYL2THIOPHENECARBOXAMIDE
4cyanoNN3trimethyl5(((4nitrophenoxy)acetyl)amino)thiophene2carboxamide
4CYANONN3TRIMETHYL5((2(4NITROPHENOXY)ACETYL)AMINO)THIOPHENE2CARBOXAMIDE
514818032
CC1=C(SC(=C1C#N)NC(=O)COC2=CC=C(C=C2)(N+)(=O)(O))C(=O)N(C)C
InChI=1SC17H16N4O5Sc11013(818)16(2715(10)17(23)20(2)3)1914(22)926126411(5712)21(24)25h47H9H213H3(H1922)
MFCD03757511
N#Cc1c(NC(=O)COc2ccc(cc2)(N+)(=O)(O))sc(c1C)C(=O)N(C)C
ZINC000002760171
ZINC02760171
ZINC2760171

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Available files

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