[(1S)-1-(2-chlorophenyl)-2-[(4-ethoxyphenyl)carbamothioylamino]ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-1-(2-chlorophenyl)-2-[(4-ethoxyphenyl)carbamothioylamino]ethyl]-dimethyl-azanium Openeye Name: [(1S)-1-(2-chlorophenyl)-2-[(4-ethoxyphenyl)carbamothioylamino]ethyl]-dimethyl-ammonium CAS Name: [(1S)-1-(2-chlorophenyl)-2-[[(4-ethoxyanilino)-sulfanylidenemethyl]amino]ethyl]-dimethylammonium IUPAC Name: [(1S)-1-(2-chlorophenyl)-2-[(4-ethoxyphenyl)carbamothioylamino]ethyl]-dimethylazanium Traditional Name: [(1S)-1-(2-chlorophenyl)-2-(p-phenetylthiocarbamoylamino)ethyl]-dimethyl-ammonium Formula: C19H25ClN3OS+ MolecularWeight: 378.9393

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)NCC(C2=CC=CC=C2Cl)[NH+](C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)NC[C@H](C2=CC=CC=C2Cl)[NH+](C)C

InChI

InChI=1S/C19H24ClN3OS/c1-4-24-15-11-9-14(10-12-15)22-19(25)21-13-18(23(2)3)16-7-5-6-8-17(16)20/h5-12,18H,4,13H2,1-3H3,(H2,21,22,25)/p+1/t18-/m1/s1