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CHEBI:45411 - (S)-4-{4-[3-(3-carbamimidoylphenyl)-2-(2,4,6-triisopropylbenzenesulfonamido)propanoyl]piperazin-1-ylcarbonyl}piperidine-1-carboximidamide
| Formula | C36H54N8O4S |
| Net Charge | 0 |
| Average Mass | 694.947 |
| Monoisotopic Mass | 694.39887 |
| SMILES | [H]/N=C(/c1c([H])c([H])c([H])c(C([H])([H])[C@@]([H])(C(=O)N2C([H])([H])C([H])([H])N(C(=O)C3([H])C([H])([H])C([H])([H])N(/C(=N/[H])N([H])[H])C([H])([H])C3([H])[H])C([H])([H])C2([H])[H])N([H])S(=O)(=O)c2c(C([H])(C([H])([H])[H])C([H])([H])[H])c([H])c(C([H])(C([H])([H])[H])C([H])([H])[H])c([H])c2C([H])(C([H])([H])[H])C([H])([H])[H])c1[H])N([H])[H] |
| InChI | InChI=1S/C36H54N8O4S/c1-22(2)28-20-29(23(3)4)32(30(21-28)24(5)6)49(47,48)41-31(19-25-8-7-9-27(18-25)33(37)38)35(46)43-16-14-42(15-17-43)34(45)26-10-12-44(13-11-26)36(39)40/h7-9,18,20-24,26,31,41H,10-17,19H2,1-6H3,(H3,37,38)(H3,39,40)/t31-/m0/s1 |
| InChIKey | KSEVHDWJTMMENT-HKBQPEDESA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (S)-4-{4-[3-(3-carbamimidoylphenyl)-2-(2,4,6-triisopropylbenzenesulfonamido)propanoyl]piperazin-1-ylcarbonyl}piperidine-1-carboximidamide (CHEBI:45411) is a N-acylpiperidine (CHEBI:48591) |
| (S)-4-{4-[3-(3-carbamimidoylphenyl)-2-(2,4,6-triisopropylbenzenesulfonamido)propanoyl]piperazin-1-ylcarbonyl}piperidine-1-carboximidamide (CHEBI:45411) is a carboxamidine (CHEBI:35359) |
| (S)-4-{4-[3-(3-carbamimidoylphenyl)-2-(2,4,6-triisopropylbenzenesulfonamido)propanoyl]piperazin-1-ylcarbonyl}piperidine-1-carboximidamide (CHEBI:45411) is a sulfonamide (CHEBI:35358) |
| Synonyms | Source |
|---|---|
| (S)-4-(4-(3-(3-CARBAMIMIDOYLPHENYL)-2-(2,4,6-TRIISOPROPYLPHENYLSULFONAMIDO)PROPANOYL)PIPERAZINE-1-CARBONYL)PIPERIDINE-1-CARBOXIMIDAMIDE | PDBeChem |
| 4-({4-[(2S)-3-(3-carbamimidoylphenyl)-2-({[2,4,6-tris(1-methylethyl)phenyl]sulfonyl}amino)propanoyl]piperazin-1-yl}carbonyl)piperidine-1-carboximidamide | PDBeChem |