[3-(4-methoxyphenyl)-2-sulfanylidene-benzimidazol-1-yl]methyl-methyl-[2-oxidanylidene-2-(propylamino)ethyl]azanium

Systemtic Name: [3-(4-methoxyphenyl)-2-sulfanylidene-benzimidazol-1-yl]methyl-methyl-[2-oxidanylidene-2-(propylamino)ethyl]azanium Openeye Name: [3-(4-methoxyphenyl)-2-thioxo-benzimidazol-1-yl]methyl-methyl-[2-oxo-2-(propylamino)ethyl]ammonium CAS Name: [3-(4-methoxyphenyl)-2-sulfanylidene-1-benzimidazolyl]methyl-methyl-[2-oxo-2-(propylamino)ethyl]ammonium IUPAC Name: [3-(4-methoxyphenyl)-2-sulfanylidenebenzimidazol-1-yl]methyl-methyl-[2-oxo-2-(propylamino)ethyl]azanium Traditional Name: [2-keto-2-(propylamino)ethyl]-[[3-(4-methoxyphenyl)-2-thioxo-benzimidazol-1-yl]methyl]-methyl-ammonium Formula: C21H27N4O2S+ MolecularWeight: 399.52968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C[NH+](C)CN1C2=CC=CC=C2N(C1=S)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCNC(=O)C[NH+](C)CN1C2=CC=CC=C2N(C1=S)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H26N4O2S/c1-4-13-22-20(26)14-23(2)15-24-18-7-5-6-8-19(18)25(21(24)28)16-9-11-17(27-3)12-10-16/h5-12H,4,13-15H2,1-3H3,(H,22,26)/p+1