1-(4-fluorophenyl)sulfonyl-N-[3-[methyl-(phenylmethyl)amino]propyl]pyrrolidine-2-carboxamide

Systemtic Name: 1-(4-fluorophenyl)sulfonyl-N-[3-[methyl-(phenylmethyl)amino]propyl]pyrrolidine-2-carboxamide Openeye Name: N-[3-[benzyl(methyl)amino]propyl]-1-(4-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide CAS Name: 1-(4-fluorophenyl)sulfonyl-N-[3-[methyl-(phenylmethyl)amino]propyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[3-[benzyl(methyl)amino]propyl]-1-(4-fluorophenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: N-[3-[benzyl(methyl)amino]propyl]-1-(4-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide Formula: C22H28FN3O3S MolecularWeight: 433.539423

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)C1CCCN1S(=O)(=O)C2=CC=C(C=C2)F)CC3=CC=CC=C3

Isomeric SMILES

CN(CCCNC(=O)C1CCCN1S(=O)(=O)C2=CC=C(C=C2)F)CC3=CC=CC=C3

InChI

InChI=1S/C22H28FN3O3S/c1-25(17-18-7-3-2-4-8-18)15-6-14-24-22(27)21-9-5-16-26(21)30(28,29)20-12-10-19(23)11-13-20/h2-4,7-8,10-13,21H,5-6,9,14-17H2,1H3,(H,24,27)