[(1R)-2-[[2-(2-cyanophenyl)sulfanylphenyl]carbonylamino]-1-thiophen-2-yl-ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-[[2-(2-cyanophenyl)sulfanylphenyl]carbonylamino]-1-thiophen-2-yl-ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-[[2-(2-cyanophenyl)sulfanylbenzoyl]amino]-1-(2-thienyl)ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[[[2-[(2-cyanophenyl)thio]phenyl]-oxomethyl]amino]-1-thiophen-2-ylethyl]-dimethylammonium IUPAC Name: [(1R)-2-[[2-(2-cyanophenyl)sulfanylbenzoyl]amino]-1-thiophen-2-ylethyl]-dimethylazanium Traditional Name: [(1R)-2-[[2-[(2-cyanophenyl)thio]benzoyl]amino]-1-(2-thienyl)ethyl]-dimethyl-ammonium Formula: C22H22N3OS2+ MolecularWeight: 408.55958

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)C1=CC=CC=C1SC2=CC=CC=C2C#N)C3=CC=CS3

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)C1=CC=CC=C1SC2=CC=CC=C2C#N)C3=CC=CS3

InChI

InChI=1S/C22H21N3OS2/c1-25(2)18(21-12-7-13-27-21)15-24-22(26)17-9-4-6-11-20(17)28-19-10-5-3-8-16(19)14-23/h3-13,18H,15H2,1-2H3,(H,24,26)/p+1/t18-/m1/s1