[(1S)-2-[(3-fluoranyl-4-methyl-phenyl)carbamothioylamino]-1-(2-methoxyphenyl)ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[(3-fluoranyl-4-methyl-phenyl)carbamothioylamino]-1-(2-methoxyphenyl)ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(3-fluoro-4-methyl-phenyl)carbamothioylamino]-1-(2-methoxyphenyl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[(3-fluoro-4-methylanilino)-sulfanylidenemethyl]amino]-1-(2-methoxyphenyl)ethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(3-fluoro-4-methylphenyl)carbamothioylamino]-1-(2-methoxyphenyl)ethyl]-dimethylazanium Traditional Name: [(1S)-2-[(3-fluoro-4-methyl-phenyl)thiocarbamoylamino]-1-(2-methoxyphenyl)ethyl]-dimethyl-ammonium Formula: C19H25FN3OS+ MolecularWeight: 362.484703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NCC(C2=CC=CC=C2OC)[NH+](C)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC[C@H](C2=CC=CC=C2OC)[NH+](C)C)F

InChI

InChI=1S/C19H24FN3OS/c1-13-9-10-14(11-16(13)20)22-19(25)21-12-17(23(2)3)15-7-5-6-8-18(15)24-4/h5-11,17H,12H2,1-4H3,(H2,21,22,25)/p+1/t17-/m1/s1