[(1S)-2-[(4-ethylphenyl)carbamothioylamino]-1-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[(4-ethylphenyl)carbamothioylamino]-1-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(4-ethylphenyl)carbamothioylamino]-1-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[(4-ethylanilino)-sulfanylidenemethyl]amino]-1-phenylethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(4-ethylphenyl)carbamothioylamino]-1-phenylethyl]-dimethylazanium Traditional Name: [(1S)-2-[(4-ethylphenyl)thiocarbamoylamino]-1-phenyl-ethyl]-dimethyl-ammonium Formula: C19H26N3S+ MolecularWeight: 328.49484

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=S)NCC(C2=CC=CC=C2)[NH+](C)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=S)NC[C@H](C2=CC=CC=C2)[NH+](C)C

InChI

InChI=1S/C19H25N3S/c1-4-15-10-12-17(13-11-15)21-19(23)20-14-18(22(2)3)16-8-6-5-7-9-16/h5-13,18H,4,14H2,1-3H3,(H2,20,21,23)/p+1/t18-/m1/s1