2-(3-azanyl-5-propan-2-yl-1H-pyrazol-4-yl)-1H-quinazolin-3-ium-4-one

Systemtic Name: 2-(3-azanyl-5-propan-2-yl-1H-pyrazol-4-yl)-1H-quinazolin-3-ium-4-one Openeye Name: 2-(3-amino-5-isopropyl-1H-pyrazol-4-yl)-1H-quinazolin-3-ium-4-one CAS Name: 2-(3-amino-5-propan-2-yl-1H-pyrazol-4-yl)-1H-quinazolin-3-ium-4-one IUPAC Name: 2-(3-amino-5-propan-2-yl-1H-pyrazol-4-yl)-1H-quinazolin-3-ium-4-one Traditional Name: 2-(3-amino-5-isopropyl-1H-pyrazol-4-yl)-1H-quinazolin-3-ium-4-one Formula: C14H16N5O+ MolecularWeight: 270.30974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=NN1)N)C2=[NH+]C(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC(C)C1=C(C(=NN1)N)C2=[NH+]C(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C14H15N5O/c1-7(2)11-10(12(15)19-18-11)13-16-9-6-4-3-5-8(9)14(20)17-13/h3-7H,1-2H3,(H3,15,18,19)(H,16,17,20)/p+1