N-[(2R)-3-[3,5-bis(bromanyl)-4-oxidanyl-phenyl]-1-oxidanylidene-1-(4-pyridin-4-ylpiperazin-1-yl)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-oxidanylidene-1-(4-pyridin-4-ylpiperazin-1-yl)propan-2-yl]-4-(2-oxidanylidene-1,4-dihydroquinazolin-3-yl)piperidine-1-carboxamide Openeye Name: N-[(1R)-1-[(3,5-dibromo-4-hydroxy-phenyl)methyl]-2-oxo-2-[4-(4-pyridyl)piperazin-1-yl]ethyl]-4-(2-oxo-1,4-dihydroquinazolin-3-yl)piperidine-1-carboxamide CAS Name: N-[(2R)-3-(3,5-dibromo-4-hydroxyphenyl)-1-oxo-1-(4-pyridin-4-yl-1-piperazinyl)propan-2-yl]-4-(2-oxo-1,4-dihydroquinazolin-3-yl)-1-piperidinecarboxamide IUPAC Name: N-[(2R)-3-(3,5-dibromo-4-hydroxyphenyl)-1-oxo-1-(4-pyridin-4-ylpiperazin-1-yl)propan-2-yl]-4-(2-oxo-1,4-dihydroquinazolin-3-yl)piperidine-1-carboxamide Traditional Name: N-[(1R)-1-(3,5-dibromo-4-hydroxy-benzyl)-2-keto-2-[4-(4-pyridyl)piperazino]ethyl]-4-(2-keto-1,4-dihydroquinazolin-3-yl)piperidine-1-carboxamide Formula: C32H35Br2N7O4 MolecularWeight: 741.4728

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2CC3=CC=CC=C3NC2=O)C(=O)NC(CC4=CC(=C(C(=C4)Br)O)Br)C(=O)N5CCN(CC5)C6=CC=NC=C6

Isomeric SMILES

C1CN(CCC1N2CC3=CC=CC=C3NC2=O)C(=O)N[C@H](CC4=CC(=C(C(=C4)Br)O)Br)C(=O)N5CCN(CC5)C6=CC=NC=C6

InChI

InChI=1S/C32H35Br2N7O4/c33-25-17-21(18-26(34)29(25)42)19-28(30(43)39-15-13-38(14-16-39)23-5-9-35-10-6-23)37-31(44)40-11-7-24(8-12-40)41-20-22-3-1-2-4-27(22)36-32(41)45/h1-6,9-10,17-18,24,28,42H,7-8,11-16,19-20H2,(H,36,45)(H,37,44)/t28-/m1/s1