t-Butylnitazene
| t-Butylnitazene | |
|---|---|
 | |
| Molecular structure via molpic based on CDK |
| Rotamer [] | |
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| Conformer structure via 3Dmol.js |
| Physical properties [] | |
|---|---|
| Molecular mass | 408.5 g/mol [1] |
| Predicted LogP | 5.6 [1] |
| Structural Identifiers [] | |
|---|---|
| Molecular formula | C24H32N4O2 [1] |
| IUPAC name | 2-[2-[(4-tert-butylphenyl)methyl]-5-nitrobenzimidazol-1-yl]-N,N-diethylethanamine [1] |
| SMILES | CCN(CC)CCN1C2=C(C=C(C=C2)[N+](=O)[O-])N=C1CC3=CC=C(C=C3)C(C)(C)C [1] |
| InChI | InChI=1S/C24H32N4O2/c1-6-26(7-2)14-15-27-22-13-12-20(28(29)30)17-21(22)25-23(27)16-18-8-10-19(11-9-18)24(3,4)5/h8-13,17H,6-7,14-16H2,1-5H3 [1] |
| InChIKey | AXMWMVXKPQZPDS-UHFFFAOYSA-N [1] |
t-Butylnitazene (also known as 1H-Benzimidazole-1-ethanamine, 2-((4-(1,1-dimethylethyl)phenyl)methyl)-N,N-diethyl-5-nitro- or 2-((4-(1,1-Dimethylethyl)phenyl)methyl)-N,N-diethyl-5-nitro-1H-benzimidazole-1-ethanamine) is a
Chemistry
Stereochemistry []
t-Butylnitazene is a achiral mixture.
See also []
External links []
References []
National Center for Biotechnology Information. PubChem Compound Summary for CID 162623621, t-Butylnitazene. Accessed June 7, 2026. https://pubchem.ncbi.nlm.nih.gov/compound/162623621
U.S. Food and Drug Administration; National Center for Advancing Translational Sciences. t-Butylnitazene. UNII: X3ZC5LE7SE. Global Substance Registration System. Accessed June 7, 2026. https://gsrs.ncats.nih.gov/ginas/app/beta/substances/X3ZC5LE7SE