[5-(1,3-benzothiazol-2-yl)furan-2-yl]-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: [5-(1,3-benzothiazol-2-yl)furan-2-yl]-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: [5-(1,3-benzothiazol-2-yl)-2-furyl]-[4-(2-thienylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: [5-(1,3-benzothiazol-2-yl)-2-furanyl]-[4-(thiophen-2-ylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: [5-(1,3-benzothiazol-2-yl)furan-2-yl]-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: [5-(1,3-benzothiazol-2-yl)-2-furyl]-[4-(2-thenyl)piperazin-4-ium-1-yl]methanone Formula: C21H20N3O2S2+ MolecularWeight: 410.5324

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CS2)C(=O)C3=CC=C(O3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CS2)C(=O)C3=CC=C(O3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C21H19N3O2S2/c25-21(24-11-9-23(10-12-24)14-15-4-3-13-27-15)18-8-7-17(26-18)20-22-16-5-1-2-6-19(16)28-20/h1-8,13H,9-12,14H2/p+1