4-[aminocarbonyl(phenylcarbonyl)amino]-N-[3-[4-azanyl-3,5-bis(bromanyl)phenyl]-1-oxidanylidene-1-(4-pyridin-4-ylpiperazin-1-yl)propan-2-yl]piperidine-1-carboxamide

Systemtic Name: 4-[aminocarbonyl(phenylcarbonyl)amino]-N-[3-[4-azanyl-3,5-bis(bromanyl)phenyl]-1-oxidanylidene-1-(4-pyridin-4-ylpiperazin-1-yl)propan-2-yl]piperidine-1-carboxamide Openeye Name: N-[1-[(4-amino-3,5-dibromo-phenyl)methyl]-2-oxo-2-[4-(4-pyridyl)piperazin-1-yl]ethyl]-4-[benzoyl(carbamoyl)amino]piperidine-1-carboxamide CAS Name: N-[3-(4-amino-3,5-dibromophenyl)-1-oxo-1-(4-pyridin-4-yl-1-piperazinyl)propan-2-yl]-4-[benzoyl(carbamoyl)amino]-1-piperidinecarboxamide IUPAC Name: N-[3-(4-amino-3,5-dibromophenyl)-1-oxo-1-(4-pyridin-4-ylpiperazin-1-yl)propan-2-yl]-4-[benzoyl(carbamoyl)amino]piperidine-1-carboxamide Traditional Name: N-[1-(4-amino-3,5-dibromo-benzyl)-2-keto-2-[4-(4-pyridyl)piperazino]ethyl]-4-[benzoyl(carbamoyl)amino]piperidine-1-carboxamide Formula: C32H36Br2N8O4 MolecularWeight: 756.48744

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N(C(=O)C2=CC=CC=C2)C(=O)N)C(=O)NC(CC3=CC(=C(C(=C3)Br)N)Br)C(=O)N4CCN(CC4)C5=CC=NC=C5

Isomeric SMILES

C1CN(CCC1N(C(=O)C2=CC=CC=C2)C(=O)N)C(=O)NC(CC3=CC(=C(C(=C3)Br)N)Br)C(=O)N4CCN(CC4)C5=CC=NC=C5

InChI

InChI=1S/C32H36Br2N8O4/c33-25-18-21(19-26(34)28(25)35)20-27(30(44)40-16-14-39(15-17-40)23-6-10-37-11-7-23)38-32(46)41-12-8-24(9-13-41)42(31(36)45)29(43)22-4-2-1-3-5-22/h1-7,10-11,18-19,24,27H,8-9,12-17,20,35H2,(H2,36,45)(H,38,46)