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

Systemtic Name: [(1S)-1-(3-fluorophenyl)-2-[(3-methyl-1-benzothiophen-2-yl)carbonylamino]ethyl]-dimethyl-azanium Openeye Name: [(1S)-1-(3-fluorophenyl)-2-[(3-methylbenzothiophene-2-carbonyl)amino]ethyl]-dimethyl-ammonium CAS Name: [(1S)-1-(3-fluorophenyl)-2-[[(3-methyl-1-benzothiophen-2-yl)-oxomethyl]amino]ethyl]-dimethylammonium IUPAC Name: [(1S)-1-(3-fluorophenyl)-2-[(3-methyl-1-benzothiophene-2-carbonyl)amino]ethyl]-dimethylazanium Traditional Name: [(1S)-1-(3-fluorophenyl)-2-[(3-methylbenzothiophene-2-carbonyl)amino]ethyl]-dimethyl-ammonium Formula: C20H22FN2OS+ MolecularWeight: 357.464883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C(=O)NCC(C3=CC(=CC=C3)F)[NH+](C)C

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C(=O)NC[C@H](C3=CC(=CC=C3)F)[NH+](C)C

InChI

InChI=1S/C20H21FN2OS/c1-13-16-9-4-5-10-18(16)25-19(13)20(24)22-12-17(23(2)3)14-7-6-8-15(21)11-14/h4-11,17H,12H2,1-3H3,(H,22,24)/p+1/t17-/m1/s1