N-cyano-4-(4-cyano-5-methyl-4-phenyl-hexyl)-N'-[2-(4-fluoranylphenoxy)ethyl]piperazine-1-carboximidamide

Systemtic Name: N-cyano-4-(4-cyano-5-methyl-4-phenyl-hexyl)-N'-[2-(4-fluoranylphenoxy)ethyl]piperazine-1-carboximidamide Openeye Name: N-cyano-4-(4-cyano-5-methyl-4-phenyl-hexyl)-N'-[2-(4-fluorophenoxy)ethyl]piperazine-1-carboxamidine CAS Name: N-cyano-4-(4-cyano-5-methyl-4-phenylhexyl)-N'-[2-(4-fluorophenoxy)ethyl]-1-piperazinecarboximidamide IUPAC Name: N-cyano-4-(4-cyano-5-methyl-4-phenylhexyl)-N'-[2-(4-fluorophenoxy)ethyl]piperazine-1-carboximidamide Traditional Name: N-cyano-4-(4-cyano-5-methyl-4-phenyl-hexyl)-N'-[2-(4-fluorophenoxy)ethyl]piperazine-1-carboxamidine Formula: C28H35FN6O MolecularWeight: 490.615503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCN(CC1)C(=NCCOC2=CC=C(C=C2)F)NC#N)(C#N)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(CCCN1CCN(CC1)C(=NCCOC2=CC=C(C=C2)F)NC#N)(C#N)C3=CC=CC=C3

InChI

InChI=1S/C28H35FN6O/c1-23(2)28(21-30,24-7-4-3-5-8-24)13-6-15-34-16-18-35(19-17-34)27(33-22-31)32-14-20-36-26-11-9-25(29)10-12-26/h3-5,7-12,23H,6,13-20H2,1-2H3,(H,32,33)