SpectraBase Spectrum ID |
HJfTYI0E0E8 |
Name |
3-[4'-(Ethoxycarbonyl)phenyl]-2-[(hydroxycarbonyl)methylthiomethyl]-4(3H)-quinazolin-4-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H18N2O5S |
InChI |
InChI=1S/C20H18N2O5S/c1-2-27-20(26)13-7-9-14(10-8-13)22-17(11-28-12-18(23)24)21-16-6-4-3-5-15(16)19(22)25/h3-10H,2,11-12H2,1H3,(H,23,24) |
InChIKey |
PNIKPOLECWFKAW-UHFFFAOYSA-N |
Molecular Weight |
398.433 g/mol |
SMILES |
OC(CSCC=1N(C(c2c(cccc2)N1)=O)c1ccc(C(=O)OCC)cc1)=O |
SPLASH |
splash10-0a4i-0029000000-54730217c81469497184 |
Source of Spectrum |
G-58-1967-0 |
Wiley ID |
748620 |