| SpectraBase Spectrum ID |
GTbYCRiSqo8 |
| Name |
3-[3-(p-Chlorophenyl)-2-thioureido]-3,4-dihydro-4-oxo-2-quinazoline carboxylic acid, ethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
402.055339230 u |
| Formula |
C18H15ClN4O3S |
| InChI |
InChI=1S/C18H15ClN4O3S/c1-2-26-17(25)15-21-14-6-4-3-5-13(14)16(24)23(15)22-18(27)20-12-9-7-11(19)8-10-12/h3-10H,2H2,1H3,(H2,20,22,27) |
| InChIKey |
PASVQNDCVAUEFR-UHFFFAOYSA-N |
| Molecular Weight |
402.856 g/mol |
| SMILES |
N(N1C(=NC=2C=CC=CC2C1=O)C(=O)OCC)C(NC=1C=CC(=CC1)Cl)=S |
![3-[3-(p-Chlorophenyl)-2-thioureido]-3,4-dihydro-4-oxo-2-quinazoline carboxylic acid, ethyl ester](/api/spectrum/GTbYCRiSqo8/structure.png?h=300&w=458 "3-[3-(p-Chlorophenyl)-2-thioureido]-3,4-dihydro-4-oxo-2-quinazoline carboxylic acid, ethyl ester")
