3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[3-(2-fluoranylphenoxy)propyl]benzamide

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[3-(2-fluoranylphenoxy)propyl]benzamide Openeye Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[3-(2-fluorophenoxy)propyl]benzamide CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[3-(2-fluorophenoxy)propyl]benzamide IUPAC Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[3-(2-fluorophenoxy)propyl]benzamide Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[3-(2-fluorophenoxy)propyl]benzamide Formula: C25H25FN2O4S MolecularWeight: 468.540403

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=CC(=C3)C(=O)NCCCOC4=CC=CC=C4F

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=CC(=C3)C(=O)NCCCOC4=CC=CC=C4F

InChI

InChI=1S/C25H25FN2O4S/c26-23-11-3-4-12-24(23)32-16-6-14-27-25(29)20-9-5-10-22(17-20)33(30,31)28-15-13-19-7-1-2-8-21(19)18-28/h1-5,7-12,17H,6,13-16,18H2,(H,27,29)