N-[(2R)-3-[3,5-bis(bromanyl)-4-oxidanyl-phenyl]-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-1-oxidanylidene-propan-2-yl]-4-(3-oxidanylidene-5-phenyl-1H-1,2,4-triazol-2-yl)piperidine-1-carboxamide

Systemtic Name: N-[(2R)-3-[3,5-bis(bromanyl)-4-oxidanyl-phenyl]-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-1-oxidanylidene-propan-2-yl]-4-(3-oxidanylidene-5-phenyl-1H-1,2,4-triazol-2-yl)piperidine-1-carboxamide Openeye Name: N-[(1R)-1-[(3,5-dibromo-4-hydroxy-phenyl)methyl]-2-[4-(1-methyl-4-piperidyl)-1-piperidyl]-2-oxo-ethyl]-4-(3-oxo-5-phenyl-1H-1,2,4-triazol-2-yl)piperidine-1-carboxamide CAS Name: N-[(2R)-3-(3,5-dibromo-4-hydroxyphenyl)-1-[4-(1-methyl-4-piperidinyl)-1-piperidinyl]-1-oxopropan-2-yl]-4-(3-oxo-5-phenyl-1H-1,2,4-triazol-2-yl)-1-piperidinecarboxamide IUPAC Name: N-[(2R)-3-(3,5-dibromo-4-hydroxyphenyl)-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-1-oxopropan-2-yl]-4-(3-oxo-5-phenyl-1H-1,2,4-triazol-2-yl)piperidine-1-carboxamide Traditional Name: N-[(1R)-1-(3,5-dibromo-4-hydroxy-benzyl)-2-keto-2-[4-(1-methyl-4-piperidyl)piperidino]ethyl]-4-(3-keto-5-phenyl-1H-1,2,4-triazol-2-yl)piperidine-1-carboxamide Formula: C34H43Br2N7O4 MolecularWeight: 773.55772

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)C2CCN(CC2)C(=O)C(CC3=CC(=C(C(=C3)Br)O)Br)NC(=O)N4CCC(CC4)N5C(=O)N=C(N5)C6=CC=CC=C6

Isomeric SMILES

CN1CCC(CC1)C2CCN(CC2)C(=O)[C@@H](CC3=CC(=C(C(=C3)Br)O)Br)NC(=O)N4CCC(CC4)N5C(=O)N=C(N5)C6=CC=CC=C6

InChI

InChI=1S/C34H43Br2N7O4/c1-40-13-7-23(8-14-40)24-9-15-41(16-10-24)32(45)29(21-22-19-27(35)30(44)28(36)20-22)37-33(46)42-17-11-26(12-18-42)43-34(47)38-31(39-43)25-5-3-2-4-6-25/h2-6,19-20,23-24,26,29,44H,7-18,21H2,1H3,(H,37,46)(H,38,39,47)/t29-/m1/s1