4-(4-ethylpiperazin-1-yl)-N-[(3-fluorophenyl)methyl]-2-phenyl-pyrimidine-5-carboxamide

Systemtic Name: 4-(4-ethylpiperazin-1-yl)-N-[(3-fluorophenyl)methyl]-2-phenyl-pyrimidine-5-carboxamide Openeye Name: 4-(4-ethylpiperazin-1-yl)-N-[(3-fluorophenyl)methyl]-2-phenyl-pyrimidine-5-carboxamide CAS Name: 4-(4-ethyl-1-piperazinyl)-N-[(3-fluorophenyl)methyl]-2-phenyl-5-pyrimidinecarboxamide IUPAC Name: 4-(4-ethylpiperazin-1-yl)-N-[(3-fluorophenyl)methyl]-2-phenylpyrimidine-5-carboxamide Traditional Name: 4-(4-ethylpiperazino)-N-(3-fluorobenzyl)-2-phenyl-pyrimidine-5-carboxamide Formula: C24H26FN5O MolecularWeight: 419.494543

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=NC=C2C(=O)NCC3=CC(=CC=C3)F)C4=CC=CC=C4

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=NC=C2C(=O)NCC3=CC(=CC=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C24H26FN5O/c1-2-29-11-13-30(14-12-29)23-21(17-26-22(28-23)19-8-4-3-5-9-19)24(31)27-16-18-7-6-10-20(25)15-18/h3-10,15,17H,2,11-14,16H2,1H3,(H,27,31)