[(1S)-2-[(4-methoxyphenyl)methylcarbamothioylamino]-1-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[(4-methoxyphenyl)methylcarbamothioylamino]-1-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(4-methoxyphenyl)methylcarbamothioylamino]-1-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[[(4-methoxyphenyl)methylamino]-sulfanylidenemethyl]amino]-1-phenylethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(4-methoxyphenyl)methylcarbamothioylamino]-1-phenylethyl]-dimethylazanium Traditional Name: dimethyl-[(1S)-2-(p-anisylthiocarbamoylamino)-1-phenyl-ethyl]ammonium Formula: C19H26N3OS+ MolecularWeight: 344.49424

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=S)NCC1=CC=C(C=C1)OC)C2=CC=CC=C2

Isomeric SMILES

C[NH+](C)[C@H](CNC(=S)NCC1=CC=C(C=C1)OC)C2=CC=CC=C2

InChI

InChI=1S/C19H25N3OS/c1-22(2)18(16-7-5-4-6-8-16)14-21-19(24)20-13-15-9-11-17(23-3)12-10-15/h4-12,18H,13-14H2,1-3H3,(H2,20,21,24)/p+1/t18-/m1/s1