[(1S)-1-(4-methoxyphenyl)-2-[(2-methylphenyl)carbamothioylamino]ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-1-(4-methoxyphenyl)-2-[(2-methylphenyl)carbamothioylamino]ethyl]-dimethyl-azanium Openeye Name: [(1S)-1-(4-methoxyphenyl)-2-(o-tolylcarbamothioylamino)ethyl]-dimethyl-ammonium CAS Name: [(1S)-1-(4-methoxyphenyl)-2-[[(2-methylanilino)-sulfanylidenemethyl]amino]ethyl]-dimethylammonium IUPAC Name: [(1S)-1-(4-methoxyphenyl)-2-[(2-methylphenyl)carbamothioylamino]ethyl]-dimethylazanium Traditional Name: [(1S)-1-(4-methoxyphenyl)-2-(o-tolylthiocarbamoylamino)ethyl]-dimethyl-ammonium Formula: C19H26N3OS+ MolecularWeight: 344.49424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NCC(C2=CC=C(C=C2)OC)[NH+](C)C

Isomeric SMILES

CC1=CC=CC=C1NC(=S)NC[C@H](C2=CC=C(C=C2)OC)[NH+](C)C

InChI

InChI=1S/C19H25N3OS/c1-14-7-5-6-8-17(14)21-19(24)20-13-18(22(2)3)15-9-11-16(23-4)12-10-15/h5-12,18H,13H2,1-4H3,(H2,20,21,24)/p+1/t18-/m1/s1