1-benzothiophen-2-ylmethyl-[[2-(2-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-methyl-azanium

Systemtic Name: 1-benzothiophen-2-ylmethyl-[[2-(2-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-methyl-azanium Openeye Name: benzothiophen-2-ylmethyl-[[2-(2-ethoxyphenyl)-5-methyl-oxazol-4-yl]methyl]-methyl-ammonium CAS Name: 1-benzothiophen-2-ylmethyl-[[2-(2-ethoxyphenyl)-5-methyl-4-oxazolyl]methyl]-methylammonium IUPAC Name: 1-benzothiophen-2-ylmethyl-[[2-(2-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-methylazanium Traditional Name: benzothiophen-2-ylmethyl-methyl-[(5-methyl-2-o-phenetyl-oxazol-4-yl)methyl]ammonium Formula: C23H25N2O2S+ MolecularWeight: 393.5218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=NC(=C(O2)C)C[NH+](C)CC3=CC4=CC=CC=C4S3

Isomeric SMILES

CCOC1=CC=CC=C1C2=NC(=C(O2)C)C[NH+](C)CC3=CC4=CC=CC=C4S3

InChI

InChI=1S/C23H24N2O2S/c1-4-26-21-11-7-6-10-19(21)23-24-20(16(2)27-23)15-25(3)14-18-13-17-9-5-8-12-22(17)28-18/h5-13H,4,14-15H2,1-3H3/p+1