3-bromanyl-4-[[3-[2-[4-(dimethylamino)piperidin-1-yl]ethyl]-1-benzothiophen-2-yl]methoxy]benzenecarbonitrile

Systemtic Name: 3-bromanyl-4-[[3-[2-[4-(dimethylamino)piperidin-1-yl]ethyl]-1-benzothiophen-2-yl]methoxy]benzenecarbonitrile Openeye Name: 3-bromo-4-[[3-[2-[4-(dimethylamino)-1-piperidyl]ethyl]benzothiophen-2-yl]methoxy]benzonitrile CAS Name: 3-bromo-4-[[3-[2-[4-(dimethylamino)-1-piperidinyl]ethyl]-1-benzothiophen-2-yl]methoxy]benzonitrile IUPAC Name: 3-bromo-4-[[3-[2-[4-(dimethylamino)piperidin-1-yl]ethyl]-1-benzothiophen-2-yl]methoxy]benzonitrile Traditional Name: 3-bromo-4-[[3-[2-[4-(dimethylamino)piperidino]ethyl]benzothiophen-2-yl]methoxy]benzonitrile Formula: C25H28BrN3OS MolecularWeight: 498.47832

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CCN(CC1)CCC2=C(SC3=CC=CC=C32)COC4=C(C=C(C=C4)C#N)Br

Isomeric SMILES

CN(C)C1CCN(CC1)CCC2=C(SC3=CC=CC=C32)COC4=C(C=C(C=C4)C#N)Br

InChI

InChI=1S/C25H28BrN3OS/c1-28(2)19-9-12-29(13-10-19)14-11-21-20-5-3-4-6-24(20)31-25(21)17-30-23-8-7-18(16-27)15-22(23)26/h3-8,15,19H,9-14,17H2,1-2H3