(2S)-1-[[3-[(2-fluorophenyl)methyl]-2-methylsulfonyl-imidazol-4-yl]methyl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-[[3-[(2-fluorophenyl)methyl]-2-methylsulfonyl-imidazol-4-yl]methyl]pyrrolidine-2-carboxamide Openeye Name: (2S)-1-[[3-[(2-fluorophenyl)methyl]-2-methylsulfonyl-imidazol-4-yl]methyl]pyrrolidine-2-carboxamide CAS Name: (2S)-1-[[3-[(2-fluorophenyl)methyl]-2-methylsulfonyl-4-imidazolyl]methyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-[[3-[(2-fluorophenyl)methyl]-2-methylsulfonylimidazol-4-yl]methyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-1-[[3-(2-fluorobenzyl)-2-mesyl-imidazol-4-yl]methyl]pyrrolidine-2-carboxamide Formula: C17H21FN4O3S MolecularWeight: 380.437043

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC=C(N1CC2=CC=CC=C2F)CN3CCCC3C(=O)N

Isomeric SMILES

CS(=O)(=O)C1=NC=C(N1CC2=CC=CC=C2F)CN3CCC[C@H]3C(=O)N

InChI

InChI=1S/C17H21FN4O3S/c1-26(24,25)17-20-9-13(11-21-8-4-7-15(21)16(19)23)22(17)10-12-5-2-3-6-14(12)18/h2-3,5-6,9,15H,4,7-8,10-11H2,1H3,(H2,19,23)/t15-/m0/s1