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

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl]-[(4-ethyl-5-sulfanylidene-3-thiophen-2-yl-1,2,4-triazol-1-yl)methyl]-methyl-azanium Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl]-[[4-ethyl-3-(2-thienyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]-methyl-ammonium CAS Name: [2-(tert-butylamino)-2-oxoethyl]-[(4-ethyl-5-sulfanylidene-3-thiophen-2-yl-1,2,4-triazol-1-yl)methyl]-methylammonium IUPAC Name: [2-(tert-butylamino)-2-oxoethyl]-[(4-ethyl-5-sulfanylidene-3-thiophen-2-yl-1,2,4-triazol-1-yl)methyl]-methylazanium Traditional Name: [2-(tert-butylamino)-2-keto-ethyl]-[[4-ethyl-3-(2-thienyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]-methyl-ammonium Formula: C16H26N5OS2+ MolecularWeight: 368.54054

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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=CS2

Isomeric SMILES

CCN1C(=NN(C1=S)C[NH+](C)CC(=O)NC(C)(C)C)C2=CC=CS2

InChI

InChI=1S/C16H25N5OS2/c1-6-20-14(12-8-7-9-24-12)18-21(15(20)23)11-19(5)10-13(22)17-16(2,3)4/h7-9H,6,10-11H2,1-5H3,(H,17,22)/p+1