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

Systemtic Name: [(1S)-1-(2-chlorophenyl)-2-[(4-methylphenyl)carbamothioylamino]ethyl]-dimethyl-azanium Openeye Name: [(1S)-1-(2-chlorophenyl)-2-(p-tolylcarbamothioylamino)ethyl]-dimethyl-ammonium CAS Name: [(1S)-1-(2-chlorophenyl)-2-[[(4-methylanilino)-sulfanylidenemethyl]amino]ethyl]-dimethylammonium IUPAC Name: [(1S)-1-(2-chlorophenyl)-2-[(4-methylphenyl)carbamothioylamino]ethyl]-dimethylazanium Traditional Name: [(1S)-1-(2-chlorophenyl)-2-(p-tolylthiocarbamoylamino)ethyl]-dimethyl-ammonium Formula: C18H23ClN3S+ MolecularWeight: 348.91332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NCC(C2=CC=CC=C2Cl)[NH+](C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)NC[C@H](C2=CC=CC=C2Cl)[NH+](C)C

InChI

InChI=1S/C18H22ClN3S/c1-13-8-10-14(11-9-13)21-18(23)20-12-17(22(2)3)15-6-4-5-7-16(15)19/h4-11,17H,12H2,1-3H3,(H2,20,21,23)/p+1/t17-/m1/s1