| SpectraBase Spectrum ID |
DlRgO4N7yXo |
| Name |
2-((1H-Benzo[d]imidazol-2-yl)methylthio)-4-phenyl-6-(4-(phenylsulfonyl)piperazin-1-yl)pyrimidine-5-carbonitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H25N7O2S2 |
| InChI |
InChI=1S/C29H25N7O2S2/c30-19-23-27(21-9-3-1-4-10-21)33-29(39-20-26-31-24-13-7-8-14-25(24)32-26)34-28(23)35-15-17-36(18-16-35)40(37,38)22-11-5-2-6-12-22/h1-14H,15-18,20H2,(H,31,32) |
| InChIKey |
DYORWOYTRRLHSI-UHFFFAOYSA-N |
| Molecular Weight |
567.686 g/mol |
| SMILES |
[nH]1c2ccccc2nc1CSc1nc(N2CCN(S(=O)(=O)c3ccccc3)CC2)c(c(-c2ccccc2)n1)C#N |
| SPLASH |
splash10-014i-0090000000-7477d75b7b7004ced135 |
| Source of Spectrum |
F2-45-2342-21 |
| Synonyms |
4-[4-(benzenesulfonyl)-1-piperazinyl]-2-(1H-benzimidazol-2-ylmethylthio)-6-phenyl-5-pyrimidinecarbonitrile
4-[4-(benzenesulfonyl)piperazin-1-yl]-2-(1H-benzimidazol-2-ylmethylsulfanyl)-6-phenylpyrimidine-5-carbonitrile
4-[4-(benzenesulfonyl)piperazin-1-yl]-2-(1H-benzimidazol-2-ylmethylsulfanyl)-6-phenyl-pyrimidine-5-carbonitrile
2-(1H-benzimidazol-2-ylmethylsulfanyl)-4-phenyl-6-[4-(phenylsulfonyl)piperazin-1-yl]pyrimidine-5-carbonitrile |
| Wiley ID |
1689184 |
![2-((1H-Benzo[d]imidazol-2-yl)methylthio)-4-phenyl-6-(4-(phenylsulfonyl)piperazin-1-yl)pyrimidine-5-carbonitrile](/api/spectrum/DlRgO4N7yXo/structure.png?h=300&w=458 "2-((1H-Benzo[d]imidazol-2-yl)methylthio)-4-phenyl-6-(4-(phenylsulfonyl)piperazin-1-yl)pyrimidine-5-carbonitrile")
