[(1R)-2-[2-(4-methoxyphenyl)ethylcarbamothioylamino]-1-thiophen-2-yl-ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-[2-(4-methoxyphenyl)ethylcarbamothioylamino]-1-thiophen-2-yl-ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-[2-(4-methoxyphenyl)ethylcarbamothioylamino]-1-(2-thienyl)ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[[[2-(4-methoxyphenyl)ethylamino]-sulfanylidenemethyl]amino]-1-thiophen-2-ylethyl]-dimethylammonium IUPAC Name: [(1R)-2-[2-(4-methoxyphenyl)ethylcarbamothioylamino]-1-thiophen-2-ylethyl]-dimethylazanium Traditional Name: [(1R)-2-[2-(4-methoxyphenyl)ethylthiocarbamoylamino]-1-(2-thienyl)ethyl]-dimethyl-ammonium Formula: C18H26N3OS2+ MolecularWeight: 364.54854

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=S)NCCC1=CC=C(C=C1)OC)C2=CC=CS2

Isomeric SMILES

C[NH+](C)[C@H](CNC(=S)NCCC1=CC=C(C=C1)OC)C2=CC=CS2

InChI

InChI=1S/C18H25N3OS2/c1-21(2)16(17-5-4-12-24-17)13-20-18(23)19-11-10-14-6-8-15(22-3)9-7-14/h4-9,12,16H,10-11,13H2,1-3H3,(H2,19,20,23)/p+1/t16-/m1/s1