diethyl-[(1S)-1-phenyl-2-[[(2S)-2-phenylsulfanylpropanoyl]amino]ethyl]azanium

Systemtic Name: diethyl-[(1S)-1-phenyl-2-[[(2S)-2-phenylsulfanylpropanoyl]amino]ethyl]azanium Openeye Name: diethyl-[(1S)-1-phenyl-2-[[(2S)-2-phenylsulfanylpropanoyl]amino]ethyl]ammonium CAS Name: diethyl-[(1S)-2-[[(2S)-1-oxo-2-(phenylthio)propyl]amino]-1-phenylethyl]ammonium IUPAC Name: diethyl-[(1S)-1-phenyl-2-[[(2S)-2-phenylsulfanylpropanoyl]amino]ethyl]azanium Traditional Name: diethyl-[(1S)-1-phenyl-2-[[(2S)-2-(phenylthio)propanoyl]amino]ethyl]ammonium Formula: C21H29N2OS+ MolecularWeight: 357.53276

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CNC(=O)C(C)SC1=CC=CC=C1)C2=CC=CC=C2

Isomeric SMILES

CC[NH+](CC)[C@H](CNC(=O)[C@H](C)SC1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C21H28N2OS/c1-4-23(5-2)20(18-12-8-6-9-13-18)16-22-21(24)17(3)25-19-14-10-7-11-15-19/h6-15,17,20H,4-5,16H2,1-3H3,(H,22,24)/p+1/t17-,20+/m0/s1