ethyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-[(4-phenyl-5-sulfanylidene-1,2,3,4-tetrazol-1-yl)methyl]azanium

Systemtic Name: ethyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-[(4-phenyl-5-sulfanylidene-1,2,3,4-tetrazol-1-yl)methyl]azanium Openeye Name: ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]-[(4-phenyl-5-thioxo-tetrazol-1-yl)methyl]ammonium CAS Name: ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]-[(4-phenyl-5-sulfanylidene-1-tetrazolyl)methyl]ammonium IUPAC Name: ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]-[(4-phenyl-5-sulfanylidenetetrazol-1-yl)methyl]azanium Traditional Name: ethyl-[(4-keto-1H-quinazolin-2-yl)methyl]-[(4-phenyl-5-thioxo-tetrazol-1-yl)methyl]ammonium Formula: C19H20N7OS+ MolecularWeight: 394.4734

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=NC(=O)C2=CC=CC=C2N1)CN3C(=S)N(N=N3)C4=CC=CC=C4

Isomeric SMILES

CC[NH+](CC1=NC(=O)C2=CC=CC=C2N1)CN3C(=S)N(N=N3)C4=CC=CC=C4

InChI

InChI=1S/C19H19N7OS/c1-2-24(12-17-20-16-11-7-6-10-15(16)18(27)21-17)13-25-19(28)26(23-22-25)14-8-4-3-5-9-14/h3-11H,2,12-13H2,1H3,(H,20,21,27)/p+1