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

Systemtic Name: [(1S)-1-(2-chlorophenyl)-2-[(3-methoxyphenyl)carbamothioylamino]ethyl]-diethyl-azanium Openeye Name: [(1S)-1-(2-chlorophenyl)-2-[(3-methoxyphenyl)carbamothioylamino]ethyl]-diethyl-ammonium CAS Name: [(1S)-1-(2-chlorophenyl)-2-[[(3-methoxyanilino)-sulfanylidenemethyl]amino]ethyl]-diethylammonium IUPAC Name: [(1S)-1-(2-chlorophenyl)-2-[(3-methoxyphenyl)carbamothioylamino]ethyl]-diethylazanium Traditional Name: [(1S)-1-(2-chlorophenyl)-2-[(3-methoxyphenyl)thiocarbamoylamino]ethyl]-diethyl-ammonium Formula: C20H27ClN3OS+ MolecularWeight: 392.96588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CNC(=S)NC1=CC(=CC=C1)OC)C2=CC=CC=C2Cl

Isomeric SMILES

CC[NH+](CC)[C@H](CNC(=S)NC1=CC(=CC=C1)OC)C2=CC=CC=C2Cl

InChI

InChI=1S/C20H26ClN3OS/c1-4-24(5-2)19(17-11-6-7-12-18(17)21)14-22-20(26)23-15-9-8-10-16(13-15)25-3/h6-13,19H,4-5,14H2,1-3H3,(H2,22,23,26)/p+1/t19-/m1/s1