1-[3-[4-(1-benzothiophen-3-yl)phenoxy]propyl]-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 1-[3-[4-(1-benzothiophen-3-yl)phenoxy]propyl]-1,2,3,4-tetrahydroisoquinoline Openeye Name: 1-[3-[4-(benzothiophen-3-yl)phenoxy]propyl]-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-[3-[4-(1-benzothiophen-3-yl)phenoxy]propyl]-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-[3-[4-(1-benzothiophen-3-yl)phenoxy]propyl]-1,2,3,4-tetrahydroisoquinoline Traditional Name: 1-[3-[4-(benzothiophen-3-yl)phenoxy]propyl]-1,2,3,4-tetrahydroisoquinoline Formula: C26H25NOS MolecularWeight: 399.5478

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(C2=CC=CC=C21)CCCOC3=CC=C(C=C3)C4=CSC5=CC=CC=C54

Isomeric SMILES

C1CNC(C2=CC=CC=C21)CCCOC3=CC=C(C=C3)C4=CSC5=CC=CC=C54

InChI

InChI=1S/C26H25NOS/c1-2-7-22-19(6-1)15-16-27-25(22)9-5-17-28-21-13-11-20(12-14-21)24-18-29-26-10-4-3-8-23(24)26/h1-4,6-8,10-14,18,25,27H,5,9,15-17H2