2-[[5-[(2-hydroxyphenyl)methylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethyl-dimethyl-azanium

Systemtic Name: 2-[[5-[(2-hydroxyphenyl)methylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethyl-dimethyl-azanium Openeye Name: 2-[[5-[(2-hydroxyphenyl)methylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethyl-dimethyl-ammonium CAS Name: 2-[[5-[(2-hydroxyphenyl)methylamino]-1,3,4-thiadiazol-2-yl]thio]ethyl-dimethylammonium IUPAC Name: 2-[[5-[(2-hydroxyphenyl)methylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethyl-dimethylazanium Traditional Name: dimethyl-[2-[[5-(salicylamino)-1,3,4-thiadiazol-2-yl]thio]ethyl]ammonium Formula: C13H19N4OS2+ MolecularWeight: 311.44616

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCSC1=NN=C(S1)NCC2=CC=CC=C2O

Isomeric SMILES

C[NH+](C)CCSC1=NN=C(S1)NCC2=CC=CC=C2O

InChI

InChI=1S/C13H18N4OS2/c1-17(2)7-8-19-13-16-15-12(20-13)14-9-10-5-3-4-6-11(10)18/h3-6,18H,7-9H2,1-2H3,(H,14,15)/p+1