N-(3-fluoranyl-4-pyrrolidin-1-yl-phenyl)-2-[(2-methylphenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-(3-fluoranyl-4-pyrrolidin-1-yl-phenyl)-2-[(2-methylphenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-(3-fluoro-4-pyrrolidin-1-yl-phenyl)-2-(2-methyl-N-methylsulfonyl-anilino)acetamide CAS Name: N-[3-fluoro-4-(1-pyrrolidinyl)phenyl]-2-(2-methyl-N-methylsulfonylanilino)acetamide IUPAC Name: N-(3-fluoro-4-pyrrolidin-1-ylphenyl)-2-(2-methyl-N-methylsulfonylanilino)acetamide Traditional Name: N-(3-fluoro-4-pyrrolidino-phenyl)-2-(N-mesyl-2-methyl-anilino)acetamide Formula: C20H24FN3O3S MolecularWeight: 405.486263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(CC(=O)NC2=CC(=C(C=C2)N3CCCC3)F)S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1N(CC(=O)NC2=CC(=C(C=C2)N3CCCC3)F)S(=O)(=O)C

InChI

InChI=1S/C20H24FN3O3S/c1-15-7-3-4-8-18(15)24(28(2,26)27)14-20(25)22-16-9-10-19(17(21)13-16)23-11-5-6-12-23/h3-4,7-10,13H,5-6,11-12,14H2,1-2H3,(H,22,25)