(3-azanyl-3-sulfanylidene-propyl)-ethyl-(phenylmethyl)azanium

Systemtic Name: (3-azanyl-3-sulfanylidene-propyl)-ethyl-(phenylmethyl)azanium Openeye Name: (3-amino-3-thioxo-propyl)-benzyl-ethyl-ammonium CAS Name: (3-amino-3-sulfanylidenepropyl)-ethyl-(phenylmethyl)ammonium IUPAC Name: (3-amino-3-sulfanylidenepropyl)-benzyl-ethylazanium Traditional Name: (3-amino-3-thioxo-propyl)-benzyl-ethyl-ammonium Formula: C12H19N2S+ MolecularWeight: 223.35766

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCC(=S)N)CC1=CC=CC=C1

Isomeric SMILES

CC[NH+](CCC(=S)N)CC1=CC=CC=C1

InChI

InChI=1S/C12H18N2S/c1-2-14(9-8-12(13)15)10-11-6-4-3-5-7-11/h3-7H,2,8-10H2,1H3,(H2,13,15)/p+1