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

Systemtic Name: [(1S)-2-[(3-chlorophenyl)carbamothioylamino]-1-(2-methoxyphenyl)ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(3-chlorophenyl)carbamothioylamino]-1-(2-methoxyphenyl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[(3-chloroanilino)-sulfanylidenemethyl]amino]-1-(2-methoxyphenyl)ethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(3-chlorophenyl)carbamothioylamino]-1-(2-methoxyphenyl)ethyl]-dimethylazanium Traditional Name: [(1S)-2-[(3-chlorophenyl)thiocarbamoylamino]-1-(2-methoxyphenyl)ethyl]-dimethyl-ammonium Formula: C18H23ClN3OS+ MolecularWeight: 364.91272

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=S)NC1=CC(=CC=C1)Cl)C2=CC=CC=C2OC

Isomeric SMILES

C[NH+](C)[C@H](CNC(=S)NC1=CC(=CC=C1)Cl)C2=CC=CC=C2OC

InChI

InChI=1S/C18H22ClN3OS/c1-22(2)16(15-9-4-5-10-17(15)23-3)12-20-18(24)21-14-8-6-7-13(19)11-14/h4-11,16H,12H2,1-3H3,(H2,20,21,24)/p+1/t16-/m1/s1