(2S)-N-(2-fluoranyl-4-methyl-phenyl)-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-(2-fluoranyl-4-methyl-phenyl)-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-(2-fluoro-4-methyl-phenyl)-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-(2-fluoro-4-methylphenyl)-1-(4-methylphenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-(2-fluoro-4-methylphenyl)-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: (2S)-N-(2-fluoro-4-methyl-phenyl)-1-tosyl-pyrrolidine-2-carboxamide Formula: C19H21FN2O3S MolecularWeight: 376.445043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC3=C(C=C(C=C3)C)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)NC3=C(C=C(C=C3)C)F

InChI

InChI=1S/C19H21FN2O3S/c1-13-5-8-15(9-6-13)26(24,25)22-11-3-4-18(22)19(23)21-17-10-7-14(2)12-16(17)20/h5-10,12,18H,3-4,11H2,1-2H3,(H,21,23)/t18-/m0/s1