![N-[4-(2,4-Di-tert-pentylphenoxy)butyl]-1-hydroxy-4-(1-phenyl-1H-tetrazol-5-ylthio)-2-naphthalenecarboxamide](/api/spectrum/KVuRP7sx3Bf/structure.png?h=300&w=458 "N-[4-(2,4-Di-tert-pentylphenoxy)butyl]-1-hydroxy-4-(1-phenyl-1H-tetrazol-5-ylthio)-2-naphthalenecarboxamide")
| SpectraBase Compound ID | E7eNzDrpU6j |
|---|---|
| InChI | InChI=1S/C38H45N5O3S/c1-7-37(3,4)26-20-21-32(31(24-26)38(5,6)8-2)46-23-15-14-22-39-35(45)30-25-33(28-18-12-13-19-29(28)34(30)44)47-36-40-41-42-43(36)27-16-10-9-11-17-27/h9-13,16-21,24-25,44H,7-8,14-15,22-23H2,1-6H3,(H,39,45) |
| InChIKey | CFRUNFQXALDGBM-UHFFFAOYSA-N |
| Mol Weight | 651.9 g/mol |
| Molecular Formula | C38H45N5O3S |
| Exact Mass | 651.324312 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | KVuRP7sx3Bf |
|---|---|
| Name | N-[4-(2,4-Di-tert-pentylphenoxy)butyl]-1-hydroxy-4-(1-phenyl-1H-tetrazol-5-ylthio)-2-naphthalenecarboxamide |
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Catalog Number | 371564 |
| CAS Registry Number | 5084-12-8 |
| Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C38H45N5O3S |
| InChI | InChI=1S/C38H45N5O3S/c1-7-37(3,4)26-20-21-32(31(24-26)38(5,6)8-2)46-23-15-14-22-39-35(45)30-25-33(28-18-12-13-19-29(28)34(30)44)47-36-40-41-42-43(36)27-16-10-9-11-17-27/h9-13,16-21,24-25,44H,7-8,14-15,22-23H2,1-6H3,(H,39,45) |
| InChIKey | CFRUNFQXALDGBM-UHFFFAOYSA-N |
| Observed nucleus | 1H |
| Solvent | DMSO-d6 |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Synonyms | N-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-1-hydroxy-4-(1-phenyltetrazol-5-yl)sulfanylnaphthalene-2-carboxamide EINECS 225-796-9 SCHEMBL8088223 |
| Wiley ID | SIAL_1HNMR_007889 |