5-(4-bromophenyl)-N-[4-(4-butanoylpiperazin-1-yl)phenyl]furan-2-carboxamide

Systemtic Name: 5-(4-bromophenyl)-N-[4-(4-butanoylpiperazin-1-yl)phenyl]furan-2-carboxamide Openeye Name: 5-(4-bromophenyl)-N-[4-(4-butanoylpiperazin-1-yl)phenyl]furan-2-carboxamide CAS Name: 5-(4-bromophenyl)-N-[4-[4-(1-oxobutyl)-1-piperazinyl]phenyl]-2-furancarboxamide IUPAC Name: 5-(4-bromophenyl)-N-[4-(4-butanoylpiperazin-1-yl)phenyl]furan-2-carboxamide Traditional Name: 5-(4-bromophenyl)-N-[4-(4-butyrylpiperazino)phenyl]-2-furamide Formula: C25H26BrN3O3 MolecularWeight: 496.39624

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC=C(O3)C4=CC=C(C=C4)Br

Isomeric SMILES

CCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC=C(O3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C25H26BrN3O3/c1-2-3-24(30)29-16-14-28(15-17-29)21-10-8-20(9-11-21)27-25(31)23-13-12-22(32-23)18-4-6-19(26)7-5-18/h4-13H,2-3,14-17H2,1H3,(H,27,31)