| SpectraBase Spectrum ID |
7Vtlf3FhW3d |
| Name |
Benzoic acid, 2-[[2-[[3,4-dihydro-3-(2-methoxyphenyl)-4-oxo-2-quinazolinyl]thio]acetyl]amino]-, methyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
475.120191957 u |
| Formula |
C25H21N3O5S |
| InChI |
InChI=1S/C25H21N3O5S/c1-32-21-14-8-7-13-20(21)28-23(30)16-9-3-5-11-18(16)27-25(28)34-15-22(29)26-19-12-6-4-10-17(19)24(31)33-2/h3-14H,15H2,1-2H3,(H,26,29) |
| InChIKey |
XUBGABKTHMDEQD-UHFFFAOYSA-N |
| Molecular Weight |
475.519 g/mol |
| SMILES |
C=1C=C2C(N(C(=NC2=CC1)SCC(=O)NC1=CC=CC=C1C(OC)=O)C=1C(=CC=CC1)OC)=O |
![Benzoic acid, 2-[[2-[[3,4-dihydro-3-(2-methoxyphenyl)-4-oxo-2-quinazolinyl]thio]acetyl]amino]-, methyl ester](/api/spectrum/7Vtlf3FhW3d/structure.png?h=300&w=458 "Benzoic acid, 2-[[2-[[3,4-dihydro-3-(2-methoxyphenyl)-4-oxo-2-quinazolinyl]thio]acetyl]amino]-, methyl ester")
