(2-ethyl-1-benzofuran-3-yl)methyl-[[3-(2-methoxyphenyl)-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-methyl-azanium

Systemtic Name: (2-ethyl-1-benzofuran-3-yl)methyl-[[3-(2-methoxyphenyl)-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-methyl-azanium Openeye Name: (2-ethylbenzofuran-3-yl)methyl-[[3-(2-methoxyphenyl)-4-methyl-5-thioxo-1,2,4-triazol-1-yl]methyl]-methyl-ammonium CAS Name: (2-ethyl-3-benzofuranyl)methyl-[[3-(2-methoxyphenyl)-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-methylammonium IUPAC Name: (2-ethyl-1-benzofuran-3-yl)methyl-[[3-(2-methoxyphenyl)-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-methylazanium Traditional Name: (2-ethylbenzofuran-3-yl)methyl-[[3-(2-methoxyphenyl)-4-methyl-5-thioxo-1,2,4-triazol-1-yl]methyl]-methyl-ammonium Formula: C23H27N4O2S+ MolecularWeight: 423.55108

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2O1)C[NH+](C)CN3C(=S)N(C(=N3)C4=CC=CC=C4OC)C

Isomeric SMILES

CCC1=C(C2=CC=CC=C2O1)C[NH+](C)CN3C(=S)N(C(=N3)C4=CC=CC=C4OC)C

InChI

InChI=1S/C23H26N4O2S/c1-5-19-18(16-10-6-9-13-21(16)29-19)14-25(2)15-27-23(30)26(3)22(24-27)17-11-7-8-12-20(17)28-4/h6-13H,5,14-15H2,1-4H3/p+1