[4-[(5-bromanylthiophen-2-yl)methyl]piperazin-4-ium-1-yl]-(1H-indol-2-yl)methanone

Systemtic Name: [4-[(5-bromanylthiophen-2-yl)methyl]piperazin-4-ium-1-yl]-(1H-indol-2-yl)methanone Openeye Name: [4-[(5-bromo-2-thienyl)methyl]piperazin-4-ium-1-yl]-(1H-indol-2-yl)methanone CAS Name: [4-[(5-bromo-2-thiophenyl)methyl]-1-piperazin-4-iumyl]-(1H-indol-2-yl)methanone IUPAC Name: [4-[(5-bromothiophen-2-yl)methyl]piperazin-4-ium-1-yl]-(1H-indol-2-yl)methanone Traditional Name: [4-[(5-bromo-2-thienyl)methyl]piperazin-4-ium-1-yl]-(1H-indol-2-yl)methanone Formula: C18H19BrN3OS+ MolecularWeight: 405.33196

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(S2)Br)C(=O)C3=CC4=CC=CC=C4N3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(S2)Br)C(=O)C3=CC4=CC=CC=C4N3

InChI

InChI=1S/C18H18BrN3OS/c19-17-6-5-14(24-17)12-21-7-9-22(10-8-21)18(23)16-11-13-3-1-2-4-15(13)20-16/h1-6,11,20H,7-10,12H2/p+1