2-(4-azanyl-2-sulfanylidene-5H-1,3-thiazol-3-ium-3-yl)ethyl-(2-phenoxyethyl)azanium

Systemtic Name: 2-(4-azanyl-2-sulfanylidene-5H-1,3-thiazol-3-ium-3-yl)ethyl-(2-phenoxyethyl)azanium Openeye Name: 2-(4-amino-2-thioxo-5H-thiazol-3-ium-3-yl)ethyl-(2-phenoxyethyl)ammonium CAS Name: 2-(4-amino-2-sulfanylidene-5H-thiazol-3-ium-3-yl)ethyl-(2-phenoxyethyl)ammonium IUPAC Name: 2-(4-amino-2-sulfanylidene-5H-1,3-thiazol-3-ium-3-yl)ethyl-(2-phenoxyethyl)azanium Traditional Name: 2-(4-amino-2-thioxo-3-thiazolin-3-ium-3-yl)ethyl-(2-phenoxyethyl)ammonium Formula: C13H19N3OS2+2 MolecularWeight: 297.43946

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=[N+](C(=S)S1)CC[NH2+]CCOC2=CC=CC=C2)N

Isomeric SMILES

C1C(=[N+](C(=S)S1)CC[NH2+]CCOC2=CC=CC=C2)N

InChI

InChI=1S/C13H17N3OS2/c14-12-10-19-13(18)16(12)8-6-15-7-9-17-11-4-2-1-3-5-11/h1-5,14-15H,6-10H2/p+2