2-[1-benzofuran-2-ylcarbonyl(1,3-benzothiazol-2-yl)amino]ethyl-diethyl-azanium

Systemtic Name: 2-[1-benzofuran-2-ylcarbonyl(1,3-benzothiazol-2-yl)amino]ethyl-diethyl-azanium Openeye Name: 2-[benzofuran-2-carbonyl(1,3-benzothiazol-2-yl)amino]ethyl-diethyl-ammonium CAS Name: 2-[[2-benzofuranyl(oxo)methyl]-(1,3-benzothiazol-2-yl)amino]ethyl-diethylammonium IUPAC Name: 2-[1-benzofuran-2-carbonyl(1,3-benzothiazol-2-yl)amino]ethyl-diethylazanium Traditional Name: 2-[benzofuran-2-carbonyl(1,3-benzothiazol-2-yl)amino]ethyl-diethyl-ammonium Formula: C22H24N3O2S+ MolecularWeight: 394.50986

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN(C1=NC2=CC=CC=C2S1)C(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CC[NH+](CC)CCN(C1=NC2=CC=CC=C2S1)C(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C22H23N3O2S/c1-3-24(4-2)13-14-25(22-23-17-10-6-8-12-20(17)28-22)21(26)19-15-16-9-5-7-11-18(16)27-19/h5-12,15H,3-4,13-14H2,1-2H3/p+1