(3-butyl-1,2,4-oxadiazol-5-yl)methyl-methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium

Systemtic Name: (3-butyl-1,2,4-oxadiazol-5-yl)methyl-methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium Openeye Name: (3-butyl-1,2,4-oxadiazol-5-yl)methyl-methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium CAS Name: (3-butyl-1,2,4-oxadiazol-5-yl)methyl-methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium IUPAC Name: (3-butyl-1,2,4-oxadiazol-5-yl)methyl-methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]azanium Traditional Name: (3-butyl-1,2,4-oxadiazol-5-yl)methyl-[(4-keto-1H-quinazolin-2-yl)methyl]-methyl-ammonium Formula: C17H22N5O2+ MolecularWeight: 328.38888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NOC(=N1)C[NH+](C)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCCCC1=NOC(=N1)C[NH+](C)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C17H21N5O2/c1-3-4-9-14-19-16(24-21-14)11-22(2)10-15-18-13-8-6-5-7-12(13)17(23)20-15/h5-8H,3-4,9-11H2,1-2H3,(H,18,20,23)/p+1