N-[(2R)-3-[3,5-bis(bromanyl)-4-oxidanyl-phenyl]-1-oxidanylidene-1-(4-pyridin-4-ylpiperidin-1-yl)propan-2-yl]-4-(6,7-dimethoxy-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-ylpiperidin-1-yl)propan-2-yl]-4-(6,7-dimethoxy-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)-1-piperidyl]ethyl]-4-(6,7-dimethoxy-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-piperidinyl)propan-2-yl]-4-(6,7-dimethoxy-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-ylpiperidin-1-yl)propan-2-yl]-4-(6,7-dimethoxy-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)piperidino]ethyl]-4-(2-keto-6,7-dimethoxy-1,4-dihydroquinazolin-3-yl)piperidine-1-carboxamide Formula: C35H40Br2N6O6 MolecularWeight: 800.5367

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CN(C(=O)N2)C3CCN(CC3)C(=O)NC(CC4=CC(=C(C(=C4)Br)O)Br)C(=O)N5CCC(CC5)C6=CC=NC=C6)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CN(C(=O)N2)C3CCN(CC3)C(=O)N[C@H](CC4=CC(=C(C(=C4)Br)O)Br)C(=O)N5CCC(CC5)C6=CC=NC=C6)OC

InChI

InChI=1S/C35H40Br2N6O6/c1-48-30-18-24-20-43(35(47)39-28(24)19-31(30)49-2)25-7-13-42(14-8-25)34(46)40-29(17-21-15-26(36)32(44)27(37)16-21)33(45)41-11-5-23(6-12-41)22-3-9-38-10-4-22/h3-4,9-10,15-16,18-19,23,25,29,44H,5-8,11-14,17,20H2,1-2H3,(H,39,47)(H,40,46)/t29-/m1/s1