[(1S)-2-(ethylcarbamothioylamino)-1-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-(ethylcarbamothioylamino)-1-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-(ethylcarbamothioylamino)-1-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[ethylamino(sulfanylidene)methyl]amino]-1-phenylethyl]-dimethylammonium IUPAC Name: [(1S)-2-(ethylcarbamothioylamino)-1-phenylethyl]-dimethylazanium Traditional Name: [(1S)-2-(ethylthiocarbamoylamino)-1-phenyl-ethyl]-dimethyl-ammonium Formula: C13H22N3S+ MolecularWeight: 252.39888

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NCC(C1=CC=CC=C1)[NH+](C)C

Isomeric SMILES

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

InChI

InChI=1S/C13H21N3S/c1-4-14-13(17)15-10-12(16(2)3)11-8-6-5-7-9-11/h5-9,12H,4,10H2,1-3H3,(H2,14,15,17)/p+1/t12-/m1/s1