[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-2-oxidanylidene-ethyl]-(furan-2-ylmethyl)-methyl-azanium

Systemtic Name: [2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-2-oxidanylidene-ethyl]-(furan-2-ylmethyl)-methyl-azanium Openeye Name: [2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-2-oxo-ethyl]-(2-furylmethyl)-methyl-ammonium CAS Name: [2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-2-oxoethyl]-(2-furanylmethyl)-methylammonium IUPAC Name: [2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-2-oxoethyl]-(furan-2-ylmethyl)-methylazanium Traditional Name: [2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-2-keto-ethyl]-(2-furfuryl)-methyl-ammonium Formula: C17H20N3O2S+ MolecularWeight: 330.4246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CO1)CC(=O)N(C)CC2=NC3=CC=CC=C3S2

Isomeric SMILES

C[NH+](CC1=CC=CO1)CC(=O)N(C)CC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H19N3O2S/c1-19(10-13-6-5-9-22-13)12-17(21)20(2)11-16-18-14-7-3-4-8-15(14)23-16/h3-9H,10-12H2,1-2H3/p+1