[(1S)-2-[(4-chlorophenyl)carbamothioylamino]-1-(3-methoxyphenyl)ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[(4-chlorophenyl)carbamothioylamino]-1-(3-methoxyphenyl)ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(4-chlorophenyl)carbamothioylamino]-1-(3-methoxyphenyl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[(4-chloroanilino)-sulfanylidenemethyl]amino]-1-(3-methoxyphenyl)ethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(4-chlorophenyl)carbamothioylamino]-1-(3-methoxyphenyl)ethyl]-dimethylazanium Traditional Name: [(1S)-2-[(4-chlorophenyl)thiocarbamoylamino]-1-(3-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=C(C=C1)Cl)C2=CC(=CC=C2)OC

Isomeric SMILES

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

InChI

InChI=1S/C18H22ClN3OS/c1-22(2)17(13-5-4-6-16(11-13)23-3)12-20-18(24)21-15-9-7-14(19)8-10-15/h4-11,17H,12H2,1-3H3,(H2,20,21,24)/p+1/t17-/m1/s1