| SpectraBase Spectrum ID |
1Z1eutlR0S |
| Name |
1-Benzothiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-2-[[4-(4-nitro-1H-pyrazol-1-yl)-1-oxobutyl]amino]-, ethyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H22N4O5S |
| InChI |
InChI=1S/C18H22N4O5S/c1-2-27-18(24)16-13-6-3-4-7-14(13)28-17(16)20-15(23)8-5-9-21-11-12(10-19-21)22(25)26/h10-11H,2-9H2,1H3,(H,20,23) |
| InChIKey |
COLDTGNJXQIXQX-UHFFFAOYSA-N |
| Molecular Weight |
406.457 g/mol |
| SMILES |
N(c1c(c2CCCCc2s1)C(=O)OCC)C(=O)CCC[n]1cc(N(=O)=O)cn1 |
| SPLASH |
splash10-0fsl-8900000000-2d901d0e2ba8d4161e16 |
| Source of Spectrum |
IY-1-4514-7 |
| Synonyms |
2-[[4-(4-nitro-1-pyrazolyl)-1-oxobutyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester
Ethyl 2-[4-(4-nitropyrazol-1-yl)butanoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate
Ethyl 2-[4-(4-nitropyrazol-1-yl)butanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Wiley ID |
1653130 |
![1-Benzothiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-2-[[4-(4-nitro-1H-pyrazol-1-yl)-1-oxobutyl]amino]-, ethyl ester](/api/spectrum/1Z1eutlR0S/structure.png?h=300&w=458 "1-Benzothiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-2-[[4-(4-nitro-1H-pyrazol-1-yl)-1-oxobutyl]amino]-, ethyl ester")
