3-[4-(2-piperidin-1-ylethoxy)phenoxy]-2-(thian-4-yl)-1-benzothiophen-6-ol

Systemtic Name: 3-[4-(2-piperidin-1-ylethoxy)phenoxy]-2-(thian-4-yl)-1-benzothiophen-6-ol Openeye Name: 3-[4-[2-(1-piperidyl)ethoxy]phenoxy]-2-tetrahydrothiopyran-4-yl-benzothiophen-6-ol CAS Name: 3-[4-[2-(1-piperidinyl)ethoxy]phenoxy]-2-(4-thianyl)-1-benzothiophen-6-ol IUPAC Name: 3-[4-(2-piperidin-1-ylethoxy)phenoxy]-2-(thian-4-yl)-1-benzothiophen-6-ol Traditional Name: 3-[4-(2-piperidinoethoxy)phenoxy]-2-tetrahydrothiopyran-4-yl-benzothiophen-6-ol Formula: C26H31NO3S2 MolecularWeight: 469.65924

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCOC2=CC=C(C=C2)OC3=C(SC4=C3C=CC(=C4)O)C5CCSCC5

Isomeric SMILES

C1CCN(CC1)CCOC2=CC=C(C=C2)OC3=C(SC4=C3C=CC(=C4)O)C5CCSCC5

InChI

InChI=1S/C26H31NO3S2/c28-20-4-9-23-24(18-20)32-26(19-10-16-31-17-11-19)25(23)30-22-7-5-21(6-8-22)29-15-14-27-12-2-1-3-13-27/h4-9,18-19,28H,1-3,10-17H2