SpectraBase Spectrum ID |
ES3BMNFYL3b |
Name |
3-Thiophenecarboxylic acid, 5-acetyl-4-methyl-2-[[2-(3-nitro-1H-pyrazol-1-yl)acetyl]amino]-, ethyl ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C15H16N4O6S |
InChI |
InChI=1S/C15H16N4O6S/c1-4-25-15(22)12-8(2)13(9(3)20)26-14(12)16-11(21)7-18-6-5-10(17-18)19(23)24/h5-6H,4,7H2,1-3H3,(H,16,21) |
InChIKey |
WNRQQMYHIRXDST-UHFFFAOYSA-N |
Molecular Weight |
380.375 g/mol |
SMILES |
N(c1c(c(c(s1)C(C)=O)C)C(OCC)=O)C(=O)C[n]1nc(cc1)N(=O)=O |
SPLASH |
splash10-0a59-9286000000-c98b2fa36b3d61d73dba |
Source of Spectrum |
IY-1-4493-9 |
Synonyms |
5-Acetyl-4-methyl-2-[[2-(3-nitro-1-pyrazolyl)-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester
Ethyl 5-acetyl-4-methyl-2-[[2-(3-nitropyrazol-1-yl)acetyl]amino]thiophene-3-carboxylate
Ethyl 5-ethanoyl-4-methyl-2-[2-(3-nitropyrazol-1-yl)ethanoylamino]thiophene-3-carboxylate |
Wiley ID |
1652922 |