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

Systemtic Name: N-[(2R)-3-[3,5-bis(bromanyl)-4-oxidanyl-phenyl]-1-[4-(4-ethanoylpiperazin-1-yl)piperidin-1-yl]-1-oxidanylidene-propan-2-yl]-4-(2-oxidanylidene-1,4-dihydroquinazolin-3-yl)piperidine-1-carboxamide Openeye Name: N-[(1R)-2-[4-(4-acetylpiperazin-1-yl)-1-piperidyl]-1-[(3,5-dibromo-4-hydroxy-phenyl)methyl]-2-oxo-ethyl]-4-(2-oxo-1,4-dihydroquinazolin-3-yl)piperidine-1-carboxamide CAS Name: N-[(2R)-1-[4-(4-acetyl-1-piperazinyl)-1-piperidinyl]-3-(3,5-dibromo-4-hydroxyphenyl)-1-oxopropan-2-yl]-4-(2-oxo-1,4-dihydroquinazolin-3-yl)-1-piperidinecarboxamide IUPAC Name: N-[(2R)-1-[4-(4-acetylpiperazin-1-yl)piperidin-1-yl]-3-(3,5-dibromo-4-hydroxyphenyl)-1-oxopropan-2-yl]-4-(2-oxo-1,4-dihydroquinazolin-3-yl)piperidine-1-carboxamide Traditional Name: N-[(1R)-2-[4-(4-acetylpiperazino)piperidino]-1-(3,5-dibromo-4-hydroxy-benzyl)-2-keto-ethyl]-4-(2-keto-1,4-dihydroquinazolin-3-yl)piperidine-1-carboxamide Formula: C34H43Br2N7O5 MolecularWeight: 789.55712

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2CCN(CC2)C(=O)C(CC3=CC(=C(C(=C3)Br)O)Br)NC(=O)N4CCC(CC4)N5CC6=CC=CC=C6NC5=O

Isomeric SMILES

CC(=O)N1CCN(CC1)C2CCN(CC2)C(=O)[C@@H](CC3=CC(=C(C(=C3)Br)O)Br)NC(=O)N4CCC(CC4)N5CC6=CC=CC=C6NC5=O

InChI

InChI=1S/C34H43Br2N7O5/c1-22(44)39-14-16-40(17-15-39)25-6-10-41(11-7-25)32(46)30(20-23-18-27(35)31(45)28(36)19-23)38-33(47)42-12-8-26(9-13-42)43-21-24-4-2-3-5-29(24)37-34(43)48/h2-5,18-19,25-26,30,45H,6-17,20-21H2,1H3,(H,37,48)(H,38,47)/t30-/m1/s1