(4-azanyl-4-sulfanylidene-butyl)-methyl-(2-pyridin-2-ylethyl)azanium

Systemtic Name: (4-azanyl-4-sulfanylidene-butyl)-methyl-(2-pyridin-2-ylethyl)azanium Openeye Name: (4-amino-4-thioxo-butyl)-methyl-[2-(2-pyridyl)ethyl]ammonium CAS Name: (4-amino-4-sulfanylidenebutyl)-methyl-[2-(2-pyridinyl)ethyl]ammonium IUPAC Name: (4-amino-4-sulfanylidenebutyl)-methyl-(2-pyridin-2-ylethyl)azanium Traditional Name: (4-amino-4-thioxo-butyl)-methyl-[2-(2-pyridyl)ethyl]ammonium Formula: C12H20N3S+ MolecularWeight: 238.3723

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCC(=S)N)CCC1=CC=CC=N1

Isomeric SMILES

C[NH+](CCCC(=S)N)CCC1=CC=CC=N1

InChI

InChI=1S/C12H19N3S/c1-15(9-4-6-12(13)16)10-7-11-5-2-3-8-14-11/h2-3,5,8H,4,6-7,9-10H2,1H3,(H2,13,16)/p+1