4-[4-[[3,4-bis(fluoranyl)phenyl]carbamoylamino]phenyl]-N-butyl-piperazine-1-carboxamide

Systemtic Name: 4-[4-[[3,4-bis(fluoranyl)phenyl]carbamoylamino]phenyl]-N-butyl-piperazine-1-carboxamide Openeye Name: N-butyl-4-[4-[(3,4-difluorophenyl)carbamoylamino]phenyl]piperazine-1-carboxamide CAS Name: N-butyl-4-[4-[[(3,4-difluoroanilino)-oxomethyl]amino]phenyl]-1-piperazinecarboxamide IUPAC Name: N-butyl-4-[4-[(3,4-difluorophenyl)carbamoylamino]phenyl]piperazine-1-carboxamide Traditional Name: N-butyl-4-[4-[(3,4-difluorophenyl)carbamoylamino]phenyl]piperazine-1-carboxamide Formula: C22H27F2N5O2 MolecularWeight: 431.478886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)NC3=CC(=C(C=C3)F)F

Isomeric SMILES

CCCCNC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)NC3=CC(=C(C=C3)F)F

InChI

InChI=1S/C22H27F2N5O2/c1-2-3-10-25-22(31)29-13-11-28(12-14-29)18-7-4-16(5-8-18)26-21(30)27-17-6-9-19(23)20(24)15-17/h4-9,15H,2-3,10-14H2,1H3,(H,25,31)(H2,26,27,30)