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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24FN3OS/c1-13-8-9-15(11-17(13)20)22-19(25)21-12-18(23(2)3)14-6-5-7-16(10-14)24-4/h5-11,18H,12H2,1-4H3,(H2,21,22,25)/p+1/t18-/m1/s1