N-[2-[2-(4-cyanophenyl)ethyl]-1,3-benzoxazol-5-yl]quinoline-8-sulfonamide

Systemtic Name: N-[2-[2-(4-cyanophenyl)ethyl]-1,3-benzoxazol-5-yl]quinoline-8-sulfonamide Openeye Name: N-[2-[2-(4-cyanophenyl)ethyl]-1,3-benzoxazol-5-yl]quinoline-8-sulfonamide CAS Name: N-[2-[2-(4-cyanophenyl)ethyl]-1,3-benzoxazol-5-yl]-8-quinolinesulfonamide IUPAC Name: N-[2-[2-(4-cyanophenyl)ethyl]-1,3-benzoxazol-5-yl]quinoline-8-sulfonamide Traditional Name: N-[2-[2-(4-cyanophenyl)ethyl]-1,3-benzoxazol-5-yl]quinoline-8-sulfonamide Formula: C25H18N4O3S MolecularWeight: 454.50042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)S(=O)(=O)NC3=CC4=C(C=C3)OC(=N4)CCC5=CC=C(C=C5)C#N)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)S(=O)(=O)NC3=CC4=C(C=C3)OC(=N4)CCC5=CC=C(C=C5)C#N)N=CC=C2

InChI

InChI=1S/C25H18N4O3S/c26-16-18-8-6-17(7-9-18)10-13-24-28-21-15-20(11-12-22(21)32-24)29-33(30,31)23-5-1-3-19-4-2-14-27-25(19)23/h1-9,11-12,14-15,29H,10,13H2