[2-[2-[[2-[1-(1-adamantyl)ethylamino]ethylamino]methyl]phenyl]sulfanylphenyl]methanol

Systemtic Name: [2-[2-[[2-[1-(1-adamantyl)ethylamino]ethylamino]methyl]phenyl]sulfanylphenyl]methanol Openeye Name: [2-[2-[[2-[1-(1-adamantyl)ethylamino]ethylamino]methyl]phenyl]sulfanylphenyl]methanol CAS Name: [2-[[2-[[2-[1-(1-adamantyl)ethylamino]ethylamino]methyl]phenyl]thio]phenyl]methanol IUPAC Name: [2-[2-[[2-[1-(1-adamantyl)ethylamino]ethylamino]methyl]phenyl]sulfanylphenyl]methanol Traditional Name: [2-[[2-[[2-[1-(1-adamantyl)ethylamino]ethylamino]methyl]phenyl]thio]phenyl]methanol Formula: C28H38N2OS MolecularWeight: 450.67912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NCCNCC4=CC=CC=C4SC5=CC=CC=C5CO

Isomeric SMILES

CC(C12CC3CC(C1)CC(C3)C2)NCCNCC4=CC=CC=C4SC5=CC=CC=C5CO

InChI

InChI=1S/C28H38N2OS/c1-20(28-15-21-12-22(16-28)14-23(13-21)17-28)30-11-10-29-18-24-6-2-4-8-26(24)32-27-9-5-3-7-25(27)19-31/h2-9,20-23,29-31H,10-19H2,1H3