[(1R)-2-[[3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]carbonylamino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-[[3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]carbonylamino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-[[3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carbonyl]amino]-1-(3-thienyl)ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[[[3-(4-fluorophenyl)-2-(methylthio)-4-imidazolyl]-oxomethyl]amino]-1-(3-thiophenyl)ethyl]-dimethylammonium IUPAC Name: [(1R)-2-[[3-(4-fluorophenyl)-2-methylsulfanylimidazole-4-carbonyl]amino]-1-thiophen-3-ylethyl]-dimethylazanium Traditional Name: [(1R)-2-[[3-(4-fluorophenyl)-2-(methylthio)imidazole-4-carbonyl]amino]-1-(3-thienyl)ethyl]-dimethyl-ammonium Formula: C19H22FN4OS2+ MolecularWeight: 405.532583

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)C1=CN=C(N1C2=CC=C(C=C2)F)SC)C3=CSC=C3

Isomeric SMILES

C[NH+](C)[C@@H](CNC(=O)C1=CN=C(N1C2=CC=C(C=C2)F)SC)C3=CSC=C3

InChI

InChI=1S/C19H21FN4OS2/c1-23(2)16(13-8-9-27-12-13)10-21-18(25)17-11-22-19(26-3)24(17)15-6-4-14(20)5-7-15/h4-9,11-12,16H,10H2,1-3H3,(H,21,25)/p+1/t16-/m0/s1