4-[(4-fluoranyl-3-methyl-phenyl)-[(3S)-pyrrolidin-3-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[(4-fluoranyl-3-methyl-phenyl)-[(3S)-pyrrolidin-3-yl]amino]benzenecarbonitrile Openeye Name: 4-(4-fluoro-3-methyl-N-[(3S)-pyrrolidin-3-yl]anilino)benzonitrile CAS Name: 4-(4-fluoro-3-methyl-N-[(3S)-3-pyrrolidinyl]anilino)benzonitrile IUPAC Name: 4-(4-fluoro-3-methyl-N-[(3S)-pyrrolidin-3-yl]anilino)benzonitrile Traditional Name: 4-(4-fluoro-3-methyl-N-[(3S)-pyrrolidin-3-yl]anilino)benzonitrile Formula: C18H18FN3 MolecularWeight: 295.354023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N(C2CCNC2)C3=CC=C(C=C3)C#N)F

Isomeric SMILES

CC1=C(C=CC(=C1)N([C@H]2CCNC2)C3=CC=C(C=C3)C#N)F

InChI

InChI=1S/C18H18FN3/c1-13-10-16(6-7-18(13)19)22(17-8-9-21-12-17)15-4-2-14(11-20)3-5-15/h2-7,10,17,21H,8-9,12H2,1H3/t17-/m0/s1