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

Systemtic Name: [(1S)-2-(cyclopropylcarbamothioylamino)-1-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-(cyclopropylcarbamothioylamino)-1-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[(cyclopropylamino)-sulfanylidenemethyl]amino]-1-phenylethyl]-dimethylammonium IUPAC Name: [(1S)-2-(cyclopropylcarbamothioylamino)-1-phenylethyl]-dimethylazanium Traditional Name: [(1S)-2-(cyclopropylthiocarbamoylamino)-1-phenyl-ethyl]-dimethyl-ammonium Formula: C14H22N3S+ MolecularWeight: 264.40958

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=S)NC1CC1)C2=CC=CC=C2

Isomeric SMILES

C[NH+](C)[C@H](CNC(=S)NC1CC1)C2=CC=CC=C2

InChI

InChI=1S/C14H21N3S/c1-17(2)13(11-6-4-3-5-7-11)10-15-14(18)16-12-8-9-12/h3-7,12-13H,8-10H2,1-2H3,(H2,15,16,18)/p+1/t13-/m1/s1