3-(4-methylphenyl)sulfonyl-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]propanamide

Systemtic Name: 3-(4-methylphenyl)sulfonyl-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]propanamide Openeye Name: 3-(p-tolylsulfonyl)-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]propanamide CAS Name: 3-(4-methylphenyl)sulfonyl-N-[2-(1-pyrrolidinyl)-5-(trifluoromethyl)phenyl]propanamide IUPAC Name: 3-(4-methylphenyl)sulfonyl-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]propanamide Traditional Name: N-[2-pyrrolidino-5-(trifluoromethyl)phenyl]-3-tosyl-propionamide Formula: C21H23F3N2O3S MolecularWeight: 440.47913

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCCC3

InChI

InChI=1S/C21H23F3N2O3S/c1-15-4-7-17(8-5-15)30(28,29)13-10-20(27)25-18-14-16(21(22,23)24)6-9-19(18)26-11-2-3-12-26/h4-9,14H,2-3,10-13H2,1H3,(H,25,27)