| SpectraBase Spectrum ID |
IGOsxj8KjJg |
| Name |
3-[[(3-phenyl-4(3H)-quinazolinone-2-yl)mercaptoacetyl]hydrazono]-1H-5-methyl-2-indolinone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
469.120860663 u |
| Formula |
C25H19N5O3S |
| InChI |
InChI=1S/C25H19N5O3S/c1-15-11-12-20-18(13-15)22(23(32)26-20)29-28-21(31)14-34-25-27-19-10-6-5-9-17(19)24(33)30(25)16-7-3-2-4-8-16/h2-13H,14H2,1H3,(H,28,31)(H,26,29,32) |
| InChIKey |
SIHFEEZYDZWQIK-UHFFFAOYSA-N |
| Molecular Weight |
469.519 g/mol |
| SMILES |
C=1(N(C(C2=C(N1)C=CC=C2)=O)C=1C=CC=CC1)SCC(N\N=C/1C(NC2=C1C=C(C=C2)C)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.942113 |
![3-[[(3-phenyl-4(3H)-quinazolinone-2-yl)mercaptoacetyl]hydrazono]-1H-5-methyl-2-indolinone](/api/spectrum/IGOsxj8KjJg/structure.png?h=300&w=458 "3-[[(3-phenyl-4(3H)-quinazolinone-2-yl)mercaptoacetyl]hydrazono]-1H-5-methyl-2-indolinone")
