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

Systemtic Name: N-[(2R)-3-[4-azanyl-3,5-bis(bromanyl)phenyl]-1-oxidanylidene-1-(4-piperidin-4-ylpiperidin-1-yl)propan-2-yl]-4-(2-oxidanylidene-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidine-1-carboxamide Openeye Name: N-[(1R)-1-[(4-amino-3,5-dibromo-phenyl)methyl]-2-oxo-2-[4-(4-piperidyl)-1-piperidyl]ethyl]-4-(2-oxo-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidine-1-carboxamide CAS Name: N-[(2R)-3-(4-amino-3,5-dibromophenyl)-1-oxo-1-[4-(4-piperidinyl)-1-piperidinyl]propan-2-yl]-4-(2-oxo-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)-1-piperidinecarboxamide IUPAC Name: N-[(2R)-3-(4-amino-3,5-dibromophenyl)-1-oxo-1-(4-piperidin-4-ylpiperidin-1-yl)propan-2-yl]-4-(2-oxo-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidine-1-carboxamide Traditional Name: N-[(1R)-1-(4-amino-3,5-dibromo-benzyl)-2-keto-2-[4-(4-piperidyl)piperidino]ethyl]-4-(2-keto-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidine-1-carboxamide Formula: C34H45Br2N7O3 MolecularWeight: 759.5742

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2CCN(CC2)C(=O)C(CC3=CC(=C(C(=C3)Br)N)Br)NC(=O)N4CCC(CC4)N5CCC6=CC=CC=C6NC5=O

Isomeric SMILES

C1CNCCC1C2CCN(CC2)C(=O)[C@@H](CC3=CC(=C(C(=C3)Br)N)Br)NC(=O)N4CCC(CC4)N5CCC6=CC=CC=C6NC5=O

InChI

InChI=1S/C34H45Br2N7O3/c35-27-19-22(20-28(36)31(27)37)21-30(32(44)41-14-7-24(8-15-41)23-5-12-38-13-6-23)40-33(45)42-16-10-26(11-17-42)43-18-9-25-3-1-2-4-29(25)39-34(43)46/h1-4,19-20,23-24,26,30,38H,5-18,21,37H2,(H,39,46)(H,40,45)/t30-/m1/s1