diethyl-[(1S)-1-phenyl-2-[(phenylmethyl)carbamothioylamino]ethyl]azanium

Systemtic Name: diethyl-[(1S)-1-phenyl-2-[(phenylmethyl)carbamothioylamino]ethyl]azanium Openeye Name: [(1S)-2-(benzylcarbamothioylamino)-1-phenyl-ethyl]-diethyl-ammonium CAS Name: diethyl-[(1S)-1-phenyl-2-[[[(phenylmethyl)amino]-sulfanylidenemethyl]amino]ethyl]ammonium IUPAC Name: [(1S)-2-(benzylcarbamothioylamino)-1-phenylethyl]-diethylazanium Traditional Name: [(1S)-2-(benzylthiocarbamoylamino)-1-phenyl-ethyl]-diethyl-ammonium Formula: C20H28N3S+ MolecularWeight: 342.52142

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CNC(=S)NCC1=CC=CC=C1)C2=CC=CC=C2

Isomeric SMILES

CC[NH+](CC)[C@H](CNC(=S)NCC1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C20H27N3S/c1-3-23(4-2)19(18-13-9-6-10-14-18)16-22-20(24)21-15-17-11-7-5-8-12-17/h5-14,19H,3-4,15-16H2,1-2H3,(H2,21,22,24)/p+1/t19-/m1/s1