| SpectraBase Spectrum ID |
Jt8k4WtZKWL |
| Name |
4-Benzyl-2-[3-(2-cyanoethyl)-1-phenyl-2-thioxo-1,3,4-triiazol-5-yl)methyl]phthalazin-1(2H)-one |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H22N6OS |
| InChI |
InChI=1S/C27H22N6OS/c28-16-9-17-31-27(35)33(21-12-5-2-6-13-21)25(30-31)19-32-26(34)23-15-8-7-14-22(23)24(29-32)18-20-10-3-1-4-11-20/h1-8,10-15H,9,17-19H2 |
| InChIKey |
YHUKECJUZPFMMZ-UHFFFAOYSA-N |
| Molecular Weight |
478.574 g/mol |
| SMILES |
C=1(N(C(N(N1)CCC#N)=S)c1ccccc1)CN1N=C(Cc2ccccc2)c2c(C1=O)cccc2 |
| SPLASH |
splash10-00b9-0590800000-a951e7e7001e89949ff4 |
| Source of Spectrum |
Y1-35-1072-20 |
| Synonyms |
3-[3-[[1-oxo-4-(phenylmethyl)-2-phthalazinyl]methyl]-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]propanenitrile
3-[3-[(4-benzyl-1-oxophthalazin-2-yl)methyl]-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]propanenitrile
3-[3-[(4-benzyl-1-oxo-phthalazin-2-yl)methyl]-4-phenyl-5-thioxo-1,2,4-triazol-1-yl]propanenitrile
3-[3-[[1-oxidanylidene-4-(phenylmethyl)phthalazin-2-yl]methyl]-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]propanenitrile |
| Wiley ID |
1526819 |
![4-Benzyl-2-[3-(2-cyanoethyl)-1-phenyl-2-thioxo-1,3,4-triiazol-5-yl)methyl]phthalazin-1(2H)-one](/api/spectrum/Jt8k4WtZKWL/structure.png?h=300&w=458 "4-Benzyl-2-[3-(2-cyanoethyl)-1-phenyl-2-thioxo-1,3,4-triiazol-5-yl)methyl]phthalazin-1(2H)-one")
