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

Systemtic Name: 4-azanyl-3-bromanyl-N-[(2R)-3-bromanyl-1-oxidanylidene-1-(4-piperidin-1-ylpiperidin-1-yl)propan-2-yl]-4-(3-oxidanylidene-5-phenyl-1H-1,2,4-triazol-2-yl)-N-phenyl-piperidine-1-carboxamide Openeye Name: 4-amino-3-bromo-N-[(1R)-1-(bromomethyl)-2-oxo-2-[4-(1-piperidyl)-1-piperidyl]ethyl]-4-(3-oxo-5-phenyl-1H-1,2,4-triazol-2-yl)-N-phenyl-piperidine-1-carboxamide CAS Name: 4-amino-3-bromo-N-[(2R)-3-bromo-1-oxo-1-[4-(1-piperidinyl)-1-piperidinyl]propan-2-yl]-4-(3-oxo-5-phenyl-1H-1,2,4-triazol-2-yl)-N-phenyl-1-piperidinecarboxamide IUPAC Name: 4-amino-3-bromo-N-[(2R)-3-bromo-1-oxo-1-(4-piperidin-1-ylpiperidin-1-yl)propan-2-yl]-4-(3-oxo-5-phenyl-1H-1,2,4-triazol-2-yl)-N-phenylpiperidine-1-carboxamide Traditional Name: 4-amino-3-bromo-N-[(1R)-1-(bromomethyl)-2-keto-2-(4-piperidinopiperidino)ethyl]-4-(3-keto-5-phenyl-1H-1,2,4-triazol-2-yl)-N-phenyl-piperidine-1-carboxamide Formula: C33H42Br2N8O3 MolecularWeight: 758.54638

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2CCN(CC2)C(=O)C(CBr)N(C3=CC=CC=C3)C(=O)N4CCC(C(C4)Br)(N)N5C(=O)N=C(N5)C6=CC=CC=C6

Isomeric SMILES

C1CCN(CC1)C2CCN(CC2)C(=O)[C@H](CBr)N(C3=CC=CC=C3)C(=O)N4CCC(C(C4)Br)(N)N5C(=O)N=C(N5)C6=CC=CC=C6

InChI

InChI=1S/C33H42Br2N8O3/c34-22-27(30(44)40-19-14-25(15-20-40)39-17-8-3-9-18-39)42(26-12-6-2-7-13-26)32(46)41-21-16-33(36,28(35)23-41)43-31(45)37-29(38-43)24-10-4-1-5-11-24/h1-2,4-7,10-13,25,27-28H,3,8-9,14-23,36H2,(H,37,38,45)/t27-,28?,33?/m0/s1