1-[[6-(4-ethylpiperazin-1-yl)pyridin-3-yl]methyl]-3-[(4-fluorophenyl)methyl]urea

Systemtic Name: 1-[[6-(4-ethylpiperazin-1-yl)pyridin-3-yl]methyl]-3-[(4-fluorophenyl)methyl]urea Openeye Name: 1-[[6-(4-ethylpiperazin-1-yl)-3-pyridyl]methyl]-3-[(4-fluorophenyl)methyl]urea CAS Name: 1-[[6-(4-ethyl-1-piperazinyl)-3-pyridinyl]methyl]-3-[(4-fluorophenyl)methyl]urea IUPAC Name: 1-[[6-(4-ethylpiperazin-1-yl)pyridin-3-yl]methyl]-3-[(4-fluorophenyl)methyl]urea Traditional Name: 1-[[6-(4-ethylpiperazino)-3-pyridyl]methyl]-3-(4-fluorobenzyl)urea Formula: C20H26FN5O MolecularWeight: 371.451743

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC=C(C=C2)CNC(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CCN1CCN(CC1)C2=NC=C(C=C2)CNC(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C20H26FN5O/c1-2-25-9-11-26(12-10-25)19-8-5-17(14-22-19)15-24-20(27)23-13-16-3-6-18(21)7-4-16/h3-8,14H,2,9-13,15H2,1H3,(H2,23,24,27)