6-[4-[3-[2-(4-bromophenyl)carbonylphenoxy]propyl]piperazin-1-yl]-1,3-dimethyl-pyrimidine-2,4-dione

Systemtic Name: 6-[4-[3-[2-(4-bromophenyl)carbonylphenoxy]propyl]piperazin-1-yl]-1,3-dimethyl-pyrimidine-2,4-dione Openeye Name: 6-[4-[3-[2-(4-bromobenzoyl)phenoxy]propyl]piperazin-1-yl]-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 6-[4-[3-[2-[(4-bromophenyl)-oxomethyl]phenoxy]propyl]-1-piperazinyl]-1,3-dimethylpyrimidine-2,4-dione IUPAC Name: 6-[4-[3-[2-(4-bromobenzoyl)phenoxy]propyl]piperazin-1-yl]-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 6-[4-[3-[2-(4-bromobenzoyl)phenoxy]propyl]piperazino]-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C26H29BrN4O4 MolecularWeight: 541.43686

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C)N2CCN(CC2)CCCOC3=CC=CC=C3C(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C)N2CCN(CC2)CCCOC3=CC=CC=C3C(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C26H29BrN4O4/c1-28-23(18-24(32)29(2)26(28)34)31-15-13-30(14-16-31)12-5-17-35-22-7-4-3-6-21(22)25(33)19-8-10-20(27)11-9-19/h3-4,6-11,18H,5,12-17H2,1-2H3