[(1R)-2-[[4-(1,3-dithian-2-yl)phenyl]carbonylamino]-1-phenyl-ethyl]-diethyl-azanium

Systemtic Name: [(1R)-2-[[4-(1,3-dithian-2-yl)phenyl]carbonylamino]-1-phenyl-ethyl]-diethyl-azanium Openeye Name: [(1R)-2-[[4-(1,3-dithian-2-yl)benzoyl]amino]-1-phenyl-ethyl]-diethyl-ammonium CAS Name: [(1R)-2-[[[4-(1,3-dithian-2-yl)phenyl]-oxomethyl]amino]-1-phenylethyl]-diethylammonium IUPAC Name: [(1R)-2-[[4-(1,3-dithian-2-yl)benzoyl]amino]-1-phenylethyl]-diethylazanium Traditional Name: [(1R)-2-[[4-(1,3-dithian-2-yl)benzoyl]amino]-1-phenyl-ethyl]-diethyl-ammonium Formula: C23H31N2OS2+ MolecularWeight: 415.63504

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CNC(=O)C1=CC=C(C=C1)C2SCCCS2)C3=CC=CC=C3

Isomeric SMILES

CC[NH+](CC)[C@@H](CNC(=O)C1=CC=C(C=C1)C2SCCCS2)C3=CC=CC=C3

InChI

InChI=1S/C23H30N2OS2/c1-3-25(4-2)21(18-9-6-5-7-10-18)17-24-22(26)19-11-13-20(14-12-19)23-27-15-8-16-28-23/h5-7,9-14,21,23H,3-4,8,15-17H2,1-2H3,(H,24,26)/p+1/t21-/m0/s1