![(3-DIALLYLAMINO-5-AMINO-1H-1,2,4-TRIAZOL-1-YL)-N-[3-[3-(PIPERIDINOMETHYL)-PHENOXY]-PROPYL]-THIOAMIDE](/api/spectrum/AFXMWwqF2cG/structure.png?h=300&w=458 "(3-DIALLYLAMINO-5-AMINO-1H-1,2,4-TRIAZOL-1-YL)-N-[3-[3-(PIPERIDINOMETHYL)-PHENOXY]-PROPYL]-THIOAMIDE")
| SpectraBase Compound ID | FwvFGeru4Pc |
|---|---|
| InChI | InChI=1S/C24H35N7OS/c1-3-13-30(14-4-2)23-27-22(25)31(28-23)24(33)26-12-9-17-32-21-11-8-10-20(18-21)19-29-15-6-5-7-16-29/h3-4,8,10-11,18H,1-2,5-7,9,12-17,19H2,(H,26,33)(H2,25,27,28) |
| InChIKey | PQCXDNFYBHZUEK-UHFFFAOYSA-N |
| Mol Weight | 469.7 g/mol |
| Molecular Formula | C24H35N7OS |
| Exact Mass | 469.26238 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AFXMWwqF2cG |
|---|---|
| Name | (3-DIALLYLAMINO-5-AMINO-1H-1,2,4-TRIAZOL-1-YL)-N-[3-[3-(PIPERIDINOMETHYL)-PHENOXY]-PROPYL]-THIOAMIDE |
| Compound Number | 3/14 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C24H35N7OS |
| InChI | InChI=1S/C24H35N7OS/c1-3-13-30(14-4-2)23-27-22(25)31(28-23)24(33)26-12-9-17-32-21-11-8-10-20(18-21)19-29-15-6-5-7-16-29/h3-4,8,10-11,18H,1-2,5-7,9,12-17,19H2,(H,26,33)(H2,25,27,28) |
| InChIKey | PQCXDNFYBHZUEK-UHFFFAOYSA-N |
| Literature Reference Author | J.BARKOCZY,J.REITER |
| Literature Reference Citation | J.HETCYCL.CHEM.,28,1597(1991) |
| Literature Reference DOI | 10.1002/jhet.5570280624 |
| Molecular Weight | 469.648 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCP3724 |