1-[4-(6-azanylpyridin-2-yl)-3-(2-methylpropoxy)phenyl]-2-(4-phenethylpiperazin-1-yl)ethanol

Systemtic Name: 1-[4-(6-azanylpyridin-2-yl)-3-(2-methylpropoxy)phenyl]-2-(4-phenethylpiperazin-1-yl)ethanol Openeye Name: 1-[4-(6-amino-2-pyridyl)-3-isobutoxy-phenyl]-2-(4-phenethylpiperazin-1-yl)ethanol CAS Name: 1-[4-(6-amino-2-pyridinyl)-3-(2-methylpropoxy)phenyl]-2-(4-phenethyl-1-piperazinyl)ethanol IUPAC Name: 1-[4-(6-aminopyridin-2-yl)-3-(2-methylpropoxy)phenyl]-2-(4-phenethylpiperazin-1-yl)ethanol Traditional Name: 1-[4-(6-amino-2-pyridyl)-3-isobutoxy-phenyl]-2-(4-phenethylpiperazino)ethanol Formula: C29H38N4O2 MolecularWeight: 474.63762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=CC(=C1)C(CN2CCN(CC2)CCC3=CC=CC=C3)O)C4=NC(=CC=C4)N

Isomeric SMILES

CC(C)COC1=C(C=CC(=C1)C(CN2CCN(CC2)CCC3=CC=CC=C3)O)C4=NC(=CC=C4)N

InChI

InChI=1S/C29H38N4O2/c1-22(2)21-35-28-19-24(11-12-25(28)26-9-6-10-29(30)31-26)27(34)20-33-17-15-32(16-18-33)14-13-23-7-4-3-5-8-23/h3-12,19,22,27,34H,13-18,20-21H2,1-2H3,(H2,30,31)