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

Systemtic Name: [(1S)-1-(2-chlorophenyl)-2-[(4-methoxyphenyl)carbamothioylamino]ethyl]-diethyl-azanium Openeye Name: [(1S)-1-(2-chlorophenyl)-2-[(4-methoxyphenyl)carbamothioylamino]ethyl]-diethyl-ammonium CAS Name: [(1S)-1-(2-chlorophenyl)-2-[[(4-methoxyanilino)-sulfanylidenemethyl]amino]ethyl]-diethylammonium IUPAC Name: [(1S)-1-(2-chlorophenyl)-2-[(4-methoxyphenyl)carbamothioylamino]ethyl]-diethylazanium Traditional Name: [(1S)-1-(2-chlorophenyl)-2-[(4-methoxyphenyl)thiocarbamoylamino]ethyl]-diethyl-ammonium Formula: C20H27ClN3OS+ MolecularWeight: 392.96588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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