1-[4-[4-[3-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]propoxy]phenyl]but-3-ynyl]-1-oxidanyl-urea

Systemtic Name: 1-[4-[4-[3-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]propoxy]phenyl]but-3-ynyl]-1-oxidanyl-urea Openeye Name: 1-[4-[4-[3-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]propoxy]phenyl]but-3-ynyl]-1-hydroxy-urea CAS Name: 1-[4-[4-[3-[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]propoxy]phenyl]but-3-ynyl]-1-hydroxyurea IUPAC Name: 1-[4-[4-[3-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]propoxy]phenyl]but-3-ynyl]-1-hydroxyurea Traditional Name: 1-[4-[4-[3-[4-[bis(4-fluorophenyl)methyl]piperazino]propoxy]phenyl]but-3-ynyl]-1-hydroxy-urea Formula: C31H34F2N4O3 MolecularWeight: 548.623466

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCOC2=CC=C(C=C2)C#CCCN(C(=O)N)O)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1CCCOC2=CC=C(C=C2)C#CCCN(C(=O)N)O)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

InChI

InChI=1S/C31H34F2N4O3/c32-27-11-7-25(8-12-27)30(26-9-13-28(33)14-10-26)36-21-19-35(20-22-36)17-3-23-40-29-15-5-24(6-16-29)4-1-2-18-37(39)31(34)38/h5-16,30,39H,2-3,17-23H2,(H2,34,38)