N-(2-fluorophenyl)-4-[4-[2-(propan-2-ylamino)ethanoylamino]phenyl]piperazine-1-carboxamide

Systemtic Name: N-(2-fluorophenyl)-4-[4-[2-(propan-2-ylamino)ethanoylamino]phenyl]piperazine-1-carboxamide Openeye Name: N-(2-fluorophenyl)-4-[4-[[2-(isopropylamino)acetyl]amino]phenyl]piperazine-1-carboxamide CAS Name: N-(2-fluorophenyl)-4-[4-[[1-oxo-2-(propan-2-ylamino)ethyl]amino]phenyl]-1-piperazinecarboxamide IUPAC Name: N-(2-fluorophenyl)-4-[4-[[2-(propan-2-ylamino)acetyl]amino]phenyl]piperazine-1-carboxamide Traditional Name: N-(2-fluorophenyl)-4-[4-[[2-(isopropylamino)acetyl]amino]phenyl]piperazine-1-carboxamide Formula: C22H28FN5O2 MolecularWeight: 413.488423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(=O)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)NC3=CC=CC=C3F

Isomeric SMILES

CC(C)NCC(=O)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)NC3=CC=CC=C3F

InChI

InChI=1S/C22H28FN5O2/c1-16(2)24-15-21(29)25-17-7-9-18(10-8-17)27-11-13-28(14-12-27)22(30)26-20-6-4-3-5-19(20)23/h3-10,16,24H,11-15H2,1-2H3,(H,25,29)(H,26,30)