[(1S)-2-(5,6-dihydro-4H-1,3-thiazin-3-ium-2-ylamino)-1-phenyl-ethyl]-diethyl-azanium

Systemtic Name: [(1S)-2-(5,6-dihydro-4H-1,3-thiazin-3-ium-2-ylamino)-1-phenyl-ethyl]-diethyl-azanium Openeye Name: [(1S)-2-(5,6-dihydro-4H-1,3-thiazin-3-ium-2-ylamino)-1-phenyl-ethyl]-diethyl-ammonium CAS Name: [(1S)-2-(5,6-dihydro-4H-1,3-thiazin-3-ium-2-ylamino)-1-phenylethyl]-diethylammonium IUPAC Name: [(1S)-2-(5,6-dihydro-4H-1,3-thiazin-3-ium-2-ylamino)-1-phenylethyl]-diethylazanium Traditional Name: [(1S)-2-(5,6-dihydro-4H-1,3-thiazin-3-ium-2-ylamino)-1-phenyl-ethyl]-diethyl-ammonium Formula: C16H27N3S+2 MolecularWeight: 293.47068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CNC1=[NH+]CCCS1)C2=CC=CC=C2

Isomeric SMILES

CC[NH+](CC)[C@H](CNC1=[NH+]CCCS1)C2=CC=CC=C2

InChI

InChI=1S/C16H25N3S/c1-3-19(4-2)15(14-9-6-5-7-10-14)13-18-16-17-11-8-12-20-16/h5-7,9-10,15H,3-4,8,11-13H2,1-2H3,(H,17,18)/p+2/t15-/m1/s1