[(1S)-1-(2-methoxyphenyl)-2-[(3-methylphenyl)carbamothioylamino]ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-1-(2-methoxyphenyl)-2-[(3-methylphenyl)carbamothioylamino]ethyl]-dimethyl-azanium Openeye Name: [(1S)-1-(2-methoxyphenyl)-2-(m-tolylcarbamothioylamino)ethyl]-dimethyl-ammonium CAS Name: [(1S)-1-(2-methoxyphenyl)-2-[[(3-methylanilino)-sulfanylidenemethyl]amino]ethyl]-dimethylammonium IUPAC Name: [(1S)-1-(2-methoxyphenyl)-2-[(3-methylphenyl)carbamothioylamino]ethyl]-dimethylazanium Traditional Name: [(1S)-1-(2-methoxyphenyl)-2-(m-tolylthiocarbamoylamino)ethyl]-dimethyl-ammonium Formula: C19H26N3OS+ MolecularWeight: 344.49424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3OS/c1-14-8-7-9-15(12-14)21-19(24)20-13-17(22(2)3)16-10-5-6-11-18(16)23-4/h5-12,17H,13H2,1-4H3,(H2,20,21,24)/p+1/t17-/m1/s1