[5-(1-benzofuran-2-yl)-1H-pyrazol-4-yl]methyl-(2,1,3-benzothiadiazol-5-ylmethyl)-methyl-azanium

Systemtic Name: [5-(1-benzofuran-2-yl)-1H-pyrazol-4-yl]methyl-(2,1,3-benzothiadiazol-5-ylmethyl)-methyl-azanium Openeye Name: [5-(benzofuran-2-yl)-1H-pyrazol-4-yl]methyl-(2,1,3-benzothiadiazol-5-ylmethyl)-methyl-ammonium CAS Name: [5-(2-benzofuranyl)-1H-pyrazol-4-yl]methyl-(2,1,3-benzothiadiazol-5-ylmethyl)-methylammonium IUPAC Name: [5-(1-benzofuran-2-yl)-1H-pyrazol-4-yl]methyl-(2,1,3-benzothiadiazol-5-ylmethyl)-methylazanium Traditional Name: [5-(benzofuran-2-yl)-1H-pyrazol-4-yl]methyl-methyl-(piazthiol-5-ylmethyl)ammonium Formula: C20H18N5OS+ MolecularWeight: 376.45482

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC2=NSN=C2C=C1)CC3=C(NN=C3)C4=CC5=CC=CC=C5O4

Isomeric SMILES

C[NH+](CC1=CC2=NSN=C2C=C1)CC3=C(NN=C3)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C20H17N5OS/c1-25(11-13-6-7-16-17(8-13)24-27-23-16)12-15-10-21-22-20(15)19-9-14-4-2-3-5-18(14)26-19/h2-10H,11-12H2,1H3,(H,21,22)/p+1