4-[4-[2-(5-bromanyl-1H-indol-3-yl)ethyl]piperazin-1-yl]-1-prop-2-ynyl-indole

Systemtic Name: 4-[4-[2-(5-bromanyl-1H-indol-3-yl)ethyl]piperazin-1-yl]-1-prop-2-ynyl-indole Openeye Name: 4-[4-[2-(5-bromo-1H-indol-3-yl)ethyl]piperazin-1-yl]-1-prop-2-ynyl-indole CAS Name: 4-[4-[2-(5-bromo-1H-indol-3-yl)ethyl]-1-piperazinyl]-1-prop-2-ynylindole IUPAC Name: 4-[4-[2-(5-bromo-1H-indol-3-yl)ethyl]piperazin-1-yl]-1-prop-2-ynylindole Traditional Name: 4-[4-[2-(5-bromo-1H-indol-3-yl)ethyl]piperazino]-1-propargyl-indole Formula: C25H25BrN4 MolecularWeight: 461.3968

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C=CC2=C1C=CC=C2N3CCN(CC3)CCC4=CNC5=C4C=C(C=C5)Br

Isomeric SMILES

C#CCN1C=CC2=C1C=CC=C2N3CCN(CC3)CCC4=CNC5=C4C=C(C=C5)Br

InChI

InChI=1S/C25H25BrN4/c1-2-10-29-12-9-21-24(29)4-3-5-25(21)30-15-13-28(14-16-30)11-8-19-18-27-23-7-6-20(26)17-22(19)23/h1,3-7,9,12,17-18,27H,8,10-11,13-16H2