[(1S)-1-(3-fluorophenyl)-2-[(3-phenylthiophen-2-yl)carbonylamino]ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-1-(3-fluorophenyl)-2-[(3-phenylthiophen-2-yl)carbonylamino]ethyl]-dimethyl-azanium Openeye Name: [(1S)-1-(3-fluorophenyl)-2-[(3-phenylthiophene-2-carbonyl)amino]ethyl]-dimethyl-ammonium CAS Name: [(1S)-1-(3-fluorophenyl)-2-[[oxo-(3-phenyl-2-thiophenyl)methyl]amino]ethyl]-dimethylammonium IUPAC Name: [(1S)-1-(3-fluorophenyl)-2-[(3-phenylthiophene-2-carbonyl)amino]ethyl]-dimethylazanium Traditional Name: [(1S)-1-(3-fluorophenyl)-2-[(3-phenylthiophene-2-carbonyl)amino]ethyl]-dimethyl-ammonium Formula: C21H22FN2OS+ MolecularWeight: 369.475583

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)C1=C(C=CS1)C2=CC=CC=C2)C3=CC(=CC=C3)F

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)C1=C(C=CS1)C2=CC=CC=C2)C3=CC(=CC=C3)F

InChI

InChI=1S/C21H21FN2OS/c1-24(2)19(16-9-6-10-17(22)13-16)14-23-21(25)20-18(11-12-26-20)15-7-4-3-5-8-15/h3-13,19H,14H2,1-2H3,(H,23,25)/p+1/t19-/m1/s1