6-butylsulfonyl-2-pentyl-4-[2-(2-piperidin-1-ylethoxy)phenoxy]-1-benzothiophen-3-ol

Systemtic Name: 6-butylsulfonyl-2-pentyl-4-[2-(2-piperidin-1-ylethoxy)phenoxy]-1-benzothiophen-3-ol Openeye Name: 6-butylsulfonyl-2-pentyl-4-[2-[2-(1-piperidyl)ethoxy]phenoxy]benzothiophen-3-ol CAS Name: 6-butylsulfonyl-2-pentyl-4-[2-[2-(1-piperidinyl)ethoxy]phenoxy]-1-benzothiophen-3-ol IUPAC Name: 6-butylsulfonyl-2-pentyl-4-[2-(2-piperidin-1-ylethoxy)phenoxy]-1-benzothiophen-3-ol Traditional Name: 2-amyl-6-butylsulfonyl-4-[2-(2-piperidinoethoxy)phenoxy]benzothiophen-3-ol Formula: C30H41NO5S2 MolecularWeight: 559.78024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C2=C(S1)C=C(C=C2OC3=CC=CC=C3OCCN4CCCCC4)S(=O)(=O)CCCC)O

Isomeric SMILES

CCCCCC1=C(C2=C(S1)C=C(C=C2OC3=CC=CC=C3OCCN4CCCCC4)S(=O)(=O)CCCC)O

InChI

InChI=1S/C30H41NO5S2/c1-3-5-8-15-27-30(32)29-26(21-23(22-28(29)37-27)38(33,34)20-6-4-2)36-25-14-10-9-13-24(25)35-19-18-31-16-11-7-12-17-31/h9-10,13-14,21-22,32H,3-8,11-12,15-20H2,1-2H3