[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl-(3-imidazol-1-ylpropyl)azanium

Systemtic Name: [5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl-(3-imidazol-1-ylpropyl)azanium Openeye Name: [5-(1,3-benzothiazol-2-yl)-2-furyl]methyl-(3-imidazol-1-ylpropyl)ammonium CAS Name: [5-(1,3-benzothiazol-2-yl)-2-furanyl]methyl-[3-(1-imidazolyl)propyl]ammonium IUPAC Name: [5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl-(3-imidazol-1-ylpropyl)azanium Traditional Name: [5-(1,3-benzothiazol-2-yl)-2-furyl]methyl-(3-imidazol-1-ylpropyl)ammonium Formula: C18H19N4OS+ MolecularWeight: 339.43466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(O3)C[NH2+]CCCN4C=CN=C4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(O3)C[NH2+]CCCN4C=CN=C4

InChI

InChI=1S/C18H18N4OS/c1-2-5-17-15(4-1)21-18(24-17)16-7-6-14(23-16)12-19-8-3-10-22-11-9-20-13-22/h1-2,4-7,9,11,13,19H,3,8,10,12H2/p+1