N-[(3R)-1-[3-[4-(4-cyanophenyl)phenoxy]propyl]pyrrolidin-3-yl]quinoline-8-sulfonamide

Systemtic Name: N-[(3R)-1-[3-[4-(4-cyanophenyl)phenoxy]propyl]pyrrolidin-3-yl]quinoline-8-sulfonamide Openeye Name: N-[(3R)-1-[3-[4-(4-cyanophenyl)phenoxy]propyl]pyrrolidin-3-yl]quinoline-8-sulfonamide CAS Name: N-[(3R)-1-[3-[4-(4-cyanophenyl)phenoxy]propyl]-3-pyrrolidinyl]-8-quinolinesulfonamide IUPAC Name: N-[(3R)-1-[3-[4-(4-cyanophenyl)phenoxy]propyl]pyrrolidin-3-yl]quinoline-8-sulfonamide Traditional Name: N-[(3R)-1-[3-[4-(4-cyanophenyl)phenoxy]propyl]pyrrolidin-3-yl]quinoline-8-sulfonamide Formula: C29H28N4O3S MolecularWeight: 512.62262

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1NS(=O)(=O)C2=CC=CC3=C2N=CC=C3)CCCOC4=CC=C(C=C4)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1CN(C[C@@H]1NS(=O)(=O)C2=CC=CC3=C2N=CC=C3)CCCOC4=CC=C(C=C4)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C29H28N4O3S/c30-20-22-7-9-23(10-8-22)24-11-13-27(14-12-24)36-19-3-17-33-18-15-26(21-33)32-37(34,35)28-6-1-4-25-5-2-16-31-29(25)28/h1-2,4-14,16,26,32H,3,15,17-19,21H2/t26-/m1/s1