N-(4-fluorophenyl)-N'-[4-methyl-2-(2-phenylethynyl)phenyl]pyrrolidine-1-carboximidamide

Systemtic Name: N-(4-fluorophenyl)-N'-[4-methyl-2-(2-phenylethynyl)phenyl]pyrrolidine-1-carboximidamide Openeye Name: N-(4-fluorophenyl)-N'-[4-methyl-2-(2-phenylethynyl)phenyl]pyrrolidine-1-carboxamidine CAS Name: N-(4-fluorophenyl)-N'-[4-methyl-2-(2-phenylethynyl)phenyl]-1-pyrrolidinecarboximidamide IUPAC Name: N-(4-fluorophenyl)-N'-[4-methyl-2-(2-phenylethynyl)phenyl]pyrrolidine-1-carboximidamide Traditional Name: N-(4-fluorophenyl)-N'-[4-methyl-2-(2-phenylethynyl)phenyl]pyrrolidine-1-carboxamidine Formula: C26H24FN3 MolecularWeight: 397.487263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N=C(NC2=CC=C(C=C2)F)N3CCCC3)C#CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)N=C(NC2=CC=C(C=C2)F)N3CCCC3)C#CC4=CC=CC=C4

InChI

InChI=1S/C26H24FN3/c1-20-9-16-25(22(19-20)11-10-21-7-3-2-4-8-21)29-26(30-17-5-6-18-30)28-24-14-12-23(27)13-15-24/h2-4,7-9,12-16,19H,5-6,17-18H2,1H3,(H,28,29)