N-[(5-chloranyl-1-benzothiophen-3-yl)methyl]-4-(2,6-dicyanophenoxy)benzenesulfonamide

Systemtic Name: N-[(5-chloranyl-1-benzothiophen-3-yl)methyl]-4-(2,6-dicyanophenoxy)benzenesulfonamide Openeye Name: N-[(5-chlorobenzothiophen-3-yl)methyl]-4-(2,6-dicyanophenoxy)benzenesulfonamide CAS Name: N-[(5-chloro-1-benzothiophen-3-yl)methyl]-4-(2,6-dicyanophenoxy)benzenesulfonamide IUPAC Name: N-[(5-chloro-1-benzothiophen-3-yl)methyl]-4-(2,6-dicyanophenoxy)benzenesulfonamide Traditional Name: N-[(5-chlorobenzothiophen-3-yl)methyl]-4-(2,6-dicyanophenoxy)benzenesulfonamide Formula: C23H14ClN3O3S2 MolecularWeight: 479.95856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)C#N)OC2=CC=C(C=C2)S(=O)(=O)NCC3=CSC4=C3C=C(C=C4)Cl)C#N

Isomeric SMILES

C1=CC(=C(C(=C1)C#N)OC2=CC=C(C=C2)S(=O)(=O)NCC3=CSC4=C3C=C(C=C4)Cl)C#N

InChI

InChI=1S/C23H14ClN3O3S2/c24-18-4-9-22-21(10-18)17(14-31-22)13-27-32(28,29)20-7-5-19(6-8-20)30-23-15(11-25)2-1-3-16(23)12-26/h1-10,14,27H,13H2