2-[4-[[5-(4-bromophenyl)furan-2-yl]methyl]piperazin-4-ium-1-yl]-1,3-thiazole

Systemtic Name: 2-[4-[[5-(4-bromophenyl)furan-2-yl]methyl]piperazin-4-ium-1-yl]-1,3-thiazole Openeye Name: 2-[4-[[5-(4-bromophenyl)-2-furyl]methyl]piperazin-4-ium-1-yl]thiazole CAS Name: 2-[4-[[5-(4-bromophenyl)-2-furanyl]methyl]-1-piperazin-4-iumyl]thiazole IUPAC Name: 2-[4-[[5-(4-bromophenyl)furan-2-yl]methyl]piperazin-4-ium-1-yl]-1,3-thiazole Traditional Name: 2-[4-[[5-(4-bromophenyl)-2-furyl]methyl]piperazin-4-ium-1-yl]thiazole Formula: C18H19BrN3OS+ MolecularWeight: 405.33196

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(O2)C3=CC=C(C=C3)Br)C4=NC=CS4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(O2)C3=CC=C(C=C3)Br)C4=NC=CS4

InChI

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