[2-(tert-butylamino)-2-oxidanylidene-ethyl]-[(4-ethyl-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-methyl-azanium

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl]-[(4-ethyl-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-methyl-azanium Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl]-[(4-ethyl-3-phenyl-5-thioxo-1,2,4-triazol-1-yl)methyl]-methyl-ammonium CAS Name: [2-(tert-butylamino)-2-oxoethyl]-[(4-ethyl-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-methylammonium IUPAC Name: [2-(tert-butylamino)-2-oxoethyl]-[(4-ethyl-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-methylazanium Traditional Name: [2-(tert-butylamino)-2-keto-ethyl]-[(4-ethyl-3-phenyl-5-thioxo-1,2,4-triazol-1-yl)methyl]-methyl-ammonium Formula: C18H28N5OS+ MolecularWeight: 362.51282

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)C[NH+](C)CC(=O)NC(C)(C)C)C2=CC=CC=C2

Isomeric SMILES

CCN1C(=NN(C1=S)C[NH+](C)CC(=O)NC(C)(C)C)C2=CC=CC=C2

InChI

InChI=1S/C18H27N5OS/c1-6-22-16(14-10-8-7-9-11-14)20-23(17(22)25)13-21(5)12-15(24)19-18(2,3)4/h7-11H,6,12-13H2,1-5H3,(H,19,24)/p+1