[(1S)-2-[(2-ethoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-methyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: [(1S)-2-[(2-ethoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-methyl-(thiophen-2-ylmethyl)azanium Openeye Name: [(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenyl-ethyl]-methyl-(2-thienylmethyl)ammonium CAS Name: [(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-methyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: [(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-methyl-(thiophen-2-ylmethyl)azanium Traditional Name: [(1S)-2-keto-2-(o-phenetidino)-1-phenyl-ethyl]-methyl-(2-thenyl)ammonium Formula: C22H25N2O2S+ MolecularWeight: 381.5111

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C(C2=CC=CC=C2)[NH+](C)CC3=CC=CS3

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)[C@H](C2=CC=CC=C2)[NH+](C)CC3=CC=CS3

InChI

InChI=1S/C22H24N2O2S/c1-3-26-20-14-8-7-13-19(20)23-22(25)21(17-10-5-4-6-11-17)24(2)16-18-12-9-15-27-18/h4-15,21H,3,16H2,1-2H3,(H,23,25)/p+1/t21-/m0/s1