diethyl-[(1S)-1-(3-methoxyphenyl)-2-(3-thiophen-2-ylpropanoylamino)ethyl]azanium

Systemtic Name: diethyl-[(1S)-1-(3-methoxyphenyl)-2-(3-thiophen-2-ylpropanoylamino)ethyl]azanium Openeye Name: diethyl-[(1S)-1-(3-methoxyphenyl)-2-[3-(2-thienyl)propanoylamino]ethyl]ammonium CAS Name: diethyl-[(1S)-1-(3-methoxyphenyl)-2-[(1-oxo-3-thiophen-2-ylpropyl)amino]ethyl]ammonium IUPAC Name: diethyl-[(1S)-1-(3-methoxyphenyl)-2-(3-thiophen-2-ylpropanoylamino)ethyl]azanium Traditional Name: diethyl-[(1S)-1-(3-methoxyphenyl)-2-[3-(2-thienyl)propanoylamino]ethyl]ammonium Formula: C20H29N2O2S+ MolecularWeight: 361.52146

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CNC(=O)CCC1=CC=CS1)C2=CC(=CC=C2)OC

Isomeric SMILES

CC[NH+](CC)[C@H](CNC(=O)CCC1=CC=CS1)C2=CC(=CC=C2)OC

InChI

InChI=1S/C20H28N2O2S/c1-4-22(5-2)19(16-8-6-9-17(14-16)24-3)15-21-20(23)12-11-18-10-7-13-25-18/h6-10,13-14,19H,4-5,11-12,15H2,1-3H3,(H,21,23)/p+1/t19-/m1/s1