5-[(2-fluorophenyl)methylsulfonylmethyl]-N-[3-[(phenylmethyl)-propan-2-yl-amino]propyl]furan-2-carboxamide

Systemtic Name: 5-[(2-fluorophenyl)methylsulfonylmethyl]-N-[3-[(phenylmethyl)-propan-2-yl-amino]propyl]furan-2-carboxamide Openeye Name: N-[3-[benzyl(isopropyl)amino]propyl]-5-[(2-fluorophenyl)methylsulfonylmethyl]furan-2-carboxamide CAS Name: 5-[(2-fluorophenyl)methylsulfonylmethyl]-N-[3-[(phenylmethyl)-propan-2-ylamino]propyl]-2-furancarboxamide IUPAC Name: N-[3-[benzyl(propan-2-yl)amino]propyl]-5-[(2-fluorophenyl)methylsulfonylmethyl]furan-2-carboxamide Traditional Name: N-[3-[benzyl(isopropyl)amino]propyl]-5-[(2-fluorobenzyl)sulfonylmethyl]-2-furamide Formula: C26H31FN2O4S MolecularWeight: 486.598743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCCNC(=O)C1=CC=C(O1)CS(=O)(=O)CC2=CC=CC=C2F)CC3=CC=CC=C3

Isomeric SMILES

CC(C)N(CCCNC(=O)C1=CC=C(O1)CS(=O)(=O)CC2=CC=CC=C2F)CC3=CC=CC=C3

InChI

InChI=1S/C26H31FN2O4S/c1-20(2)29(17-21-9-4-3-5-10-21)16-8-15-28-26(30)25-14-13-23(33-25)19-34(31,32)18-22-11-6-7-12-24(22)27/h3-7,9-14,20H,8,15-19H2,1-2H3,(H,28,30)