methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-[(4-pyrazol-1-ylphenyl)methyl]azanium

Systemtic Name: methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-[(4-pyrazol-1-ylphenyl)methyl]azanium Openeye Name: methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]-[(4-pyrazol-1-ylphenyl)methyl]ammonium CAS Name: methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]-[[4-(1-pyrazolyl)phenyl]methyl]ammonium IUPAC Name: methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]-[(4-pyrazol-1-ylphenyl)methyl]azanium Traditional Name: (4-keto-1H-quinazolin-2-yl)methyl-methyl-(4-pyrazol-1-ylbenzyl)ammonium Formula: C20H20N5O+ MolecularWeight: 346.4057

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)N2C=CC=N2)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)N2C=CC=N2)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C20H19N5O/c1-24(13-15-7-9-16(10-8-15)25-12-4-11-21-25)14-19-22-18-6-3-2-5-17(18)20(26)23-19/h2-12H,13-14H2,1H3,(H,22,23,26)/p+1