4-[[[(1S)-1-(4-fluorophenyl)ethyl]amino]methyl]-1,5-dimethyl-pyrrole-2-carbonitrile

Systemtic Name: 4-[[[(1S)-1-(4-fluorophenyl)ethyl]amino]methyl]-1,5-dimethyl-pyrrole-2-carbonitrile Openeye Name: 4-[[[(1S)-1-(4-fluorophenyl)ethyl]amino]methyl]-1,5-dimethyl-pyrrole-2-carbonitrile CAS Name: 4-[[[(1S)-1-(4-fluorophenyl)ethyl]amino]methyl]-1,5-dimethyl-2-pyrrolecarbonitrile IUPAC Name: 4-[[[(1S)-1-(4-fluorophenyl)ethyl]amino]methyl]-1,5-dimethylpyrrole-2-carbonitrile Traditional Name: 4-[[[(1S)-1-(4-fluorophenyl)ethyl]amino]methyl]-1,5-dimethyl-pyrrole-2-carbonitrile Formula: C16H18FN3 MolecularWeight: 271.332623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C)C#N)CNC(C)C2=CC=C(C=C2)F

Isomeric SMILES

CC1=C(C=C(N1C)C#N)CN[C@@H](C)C2=CC=C(C=C2)F

InChI

InChI=1S/C16H18FN3/c1-11(13-4-6-15(17)7-5-13)19-10-14-8-16(9-18)20(3)12(14)2/h4-8,11,19H,10H2,1-3H3/t11-/m0/s1