ethyl-[(4-ethyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium

Systemtic Name: ethyl-[(4-ethyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium Openeye Name: ethyl-[(4-ethyl-5-thioxo-1,2,4-triazol-1-yl)methyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium CAS Name: ethyl-[(4-ethyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium IUPAC Name: ethyl-[(4-ethyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]azanium Traditional Name: ethyl-[(4-ethyl-5-thioxo-1,2,4-triazol-1-yl)methyl]-[(4-keto-1H-quinazolin-2-yl)methyl]ammonium Formula: C16H21N6OS+ MolecularWeight: 345.44254

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NN(C1=S)C[NH+](CC)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCN1C=NN(C1=S)C[NH+](CC)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C16H20N6OS/c1-3-20(11-22-16(24)21(4-2)10-17-22)9-14-18-13-8-6-5-7-12(13)15(23)19-14/h5-8,10H,3-4,9,11H2,1-2H3,(H,18,19,23)/p+1