SpectraBase Spectrum ID |
Ax0wJS9gsWF |
Name |
2-cyano-2-[5-(4-nitrobenzoyl)-2-phenyl-thiazol-4-yl]acetic acid ethyl ester |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H15N3O5S |
InChI |
InChI=1S/C21H15N3O5S/c1-2-29-21(26)16(12-22)17-19(30-20(23-17)14-6-4-3-5-7-14)18(25)13-8-10-15(11-9-13)24(27)28/h3-11,16H,2H2,1H3 |
InChIKey |
GQAQRJTXZBXPHQ-UHFFFAOYSA-N |
Molecular Weight |
421.427 g/mol |
SMILES |
C(C(c1nc(sc1C(c1ccc(cc1)N(=O)=O)=O)-c1ccccc1)C#N)(=O)OCC |
SPLASH |
splash10-0fk9-0908400000-284241bd1141d27514bf |
Source of Spectrum |
O1-63-2326-8 |
Synonyms |
2-cyano-2-[5-[(4-nitrophenyl)-oxomethyl]-2-phenyl-4-thiazolyl]acetic acid ethyl ester
Ethyl 2-cyano-2-[5-(4-nitrobenzoyl)-2-phenyl-1,3-thiazol-4-yl]acetate
Ethyl 2-cyano-2-[5-(4-nitrobenzoyl)-2-phenyl-thiazol-4-yl]acetate
Ethyl 2-cyano-2-[5-(4-nitrophenyl)carbonyl-2-phenyl-1,3-thiazol-4-yl]ethanoate |
Wiley ID |
1592842 |