5-[4-[2-(3-bromanylphenoxy)ethyl]piperazin-1-yl]-2-propan-2-yl-2-thiophen-2-yl-pentanenitrile

Systemtic Name: 5-[4-[2-(3-bromanylphenoxy)ethyl]piperazin-1-yl]-2-propan-2-yl-2-thiophen-2-yl-pentanenitrile Openeye Name: 5-[4-[2-(3-bromophenoxy)ethyl]piperazin-1-yl]-2-isopropyl-2-(2-thienyl)pentanenitrile CAS Name: 5-[4-[2-(3-bromophenoxy)ethyl]-1-piperazinyl]-2-propan-2-yl-2-thiophen-2-ylpentanenitrile IUPAC Name: 5-[4-[2-(3-bromophenoxy)ethyl]piperazin-1-yl]-2-propan-2-yl-2-thiophen-2-ylpentanenitrile Traditional Name: 5-[4-[2-(3-bromophenoxy)ethyl]piperazino]-2-isopropyl-2-(2-thienyl)valeronitrile Formula: C24H32BrN3OS MolecularWeight: 490.49938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCN(CC1)CCOC2=CC(=CC=C2)Br)(C#N)C3=CC=CS3

Isomeric SMILES

CC(C)C(CCCN1CCN(CC1)CCOC2=CC(=CC=C2)Br)(C#N)C3=CC=CS3

InChI

InChI=1S/C24H32BrN3OS/c1-20(2)24(19-26,23-8-4-17-30-23)9-5-10-27-11-13-28(14-12-27)15-16-29-22-7-3-6-21(25)18-22/h3-4,6-8,17-18,20H,5,9-16H2,1-2H3