1-(5-fluoranyl-2-methyl-4-pyrrolidin-1-yl-phenyl)-N-[4-(4-nitrophenyl)sulfanylphenyl]methanimine

Systemtic Name: 1-(5-fluoranyl-2-methyl-4-pyrrolidin-1-yl-phenyl)-N-[4-(4-nitrophenyl)sulfanylphenyl]methanimine Openeye Name: 1-(5-fluoro-2-methyl-4-pyrrolidin-1-yl-phenyl)-N-[4-(4-nitrophenyl)sulfanylphenyl]methanimine CAS Name: 1-[5-fluoro-2-methyl-4-(1-pyrrolidinyl)phenyl]-N-[4-[(4-nitrophenyl)thio]phenyl]methanimine IUPAC Name: 1-(5-fluoro-2-methyl-4-pyrrolidin-1-ylphenyl)-N-[4-(4-nitrophenyl)sulfanylphenyl]methanimine Traditional Name: (5-fluoro-2-methyl-4-pyrrolidino-benzylidene)-[4-[(4-nitrophenyl)thio]phenyl]amine Formula: C24H22FN3O2S MolecularWeight: 435.513783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C=NC2=CC=C(C=C2)SC3=CC=C(C=C3)[N+](=O)[O-])F)N4CCCC4

Isomeric SMILES

CC1=CC(=C(C=C1C=NC2=CC=C(C=C2)SC3=CC=C(C=C3)[N+](=O)[O-])F)N4CCCC4

InChI

InChI=1S/C24H22FN3O2S/c1-17-14-24(27-12-2-3-13-27)23(25)15-18(17)16-26-19-4-8-21(9-5-19)31-22-10-6-20(7-11-22)28(29)30/h4-11,14-16H,2-3,12-13H2,1H3