(3-azanyl-3-sulfanylidene-propyl)-[(2S)-1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl]-methyl-azanium

Systemtic Name: (3-azanyl-3-sulfanylidene-propyl)-[(2S)-1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl]-methyl-azanium Openeye Name: (3-amino-3-thioxo-propyl)-[(1S)-2-(2-furylmethylamino)-1-methyl-2-oxo-ethyl]-methyl-ammonium CAS Name: (3-amino-3-sulfanylidenepropyl)-[(2S)-1-(2-furanylmethylamino)-1-oxopropan-2-yl]-methylammonium IUPAC Name: (3-amino-3-sulfanylidenepropyl)-[(2S)-1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]-methylazanium Traditional Name: (3-amino-3-thioxo-propyl)-[(1S)-2-(2-furfurylamino)-2-keto-1-methyl-ethyl]-methyl-ammonium Formula: C12H20N3O2S+ MolecularWeight: 270.3711

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CO1)[NH+](C)CCC(=S)N

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=CO1)[NH+](C)CCC(=S)N

InChI

InChI=1S/C12H19N3O2S/c1-9(15(2)6-5-11(13)18)12(16)14-8-10-4-3-7-17-10/h3-4,7,9H,5-6,8H2,1-2H3,(H2,13,18)(H,14,16)/p+1/t9-/m0/s1