Vitas-M small molecule compound

methyl (2Z)-cyano(2-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}hydrazinylidene)ethanoate

Catalog ID
STK092705
SMILES COC(=O)/C(=N\Nc1ccc(cc1)S(=O)(=O)Nc1nc(C)cc(n1)C)/C#N

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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 C16H16N6O4S MW 388.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N6O4S/c1-10-8-11(2)19-16(18-10)22-27(24,25)13-6-4-12(5-7-13)20-21-14(9-17)15(23)26-3/h4-8,20H,1-3H3,(H,18,19,22)/b21-14-
InChIKey
LBSAONYBCSVGGG-STZFKDTASA-N
Synonyms

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NN=C(C#N)C(=O)OC)C
COC(=O)C(=NNc1ccc(cc1)S(=O)(=O)Nc1nc(C)cc(n1)C)C#N
InChI=1SC16H16N6O4Sc110811(2)1916(1810)2227(2425)136412(5713)202114(917)15(23)263h4820H13H3(H181922)b2114
METHYL(2Z)2CYANO2((4((46DIMETHYLPYRIMIDIN2YL)SULFAMOYL)PHENYL)HYDRAZINYLIDENE)ACETATE
METHYL(2Z)CYANO(2(4((46DIMETHYLPYRIMIDIN2YL)SULFAMOYL)PHENYL)HYDRAZINYLIDENE)ETHANOATE
METHYLCYANO((4(((46DIMETHYLPYRIMIDIN2YL)AMINO)SULFONYL)PHENYL)HYDRAZONO)ACETATE
MFCD02025578
STK092705
ZINC000002134122
ZINC33348965

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Available files

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