| SpectraBase Spectrum ID |
LDKaRgaEkXW |
| Name |
5,6-Diphenyl-3-cyclohexyl-2-(tosylimino)-2,3-dihydropyrimidin-4(1H)-one |
| Alternate Name(s) |
N-((2E)-3-cyclohexyl-4-oxo-5,6-diphenyl-3,4-dihydro-2(1H)-pyrimidinylidene)-4-methylbenzenesulfonamide |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H29N3O3S |
| InChI |
InChI=1S/C29H29N3O3S/c1-21-17-19-25(20-18-21)36(34,35)31-29-30-27(23-13-7-3-8-14-23)26(22-11-5-2-6-12-22)28(33)32(29)24-15-9-4-10-16-24/h2-3,5-8,11-14,17-20,24H,4,9-10,15-16H2,1H3,(H,30,31) |
| InChIKey |
FBTRTPPNDHVSLF-UHFFFAOYSA-N |
| Molecular Weight |
499.629 g/mol |
| SMILES |
N1\C(N(C(C(=C1c1ccccc1)c1ccccc1)=O)C1CCCCC1)=N/S(c1ccc(cc1)C)(=O)=O |
| SPLASH |
splash10-0006-0009100000-fe50dbd931802c03fcba |
| Source of Spectrum |
KC-0-3076-11 |
| Wiley ID |
826498 |
