3-azanyl-N-(2-methylbut-3-yn-2-yl)-4-oxidanylidene-4aH-quinazolin-3-ium-2-carboxamide

Systemtic Name: 3-azanyl-N-(2-methylbut-3-yn-2-yl)-4-oxidanylidene-4aH-quinazolin-3-ium-2-carboxamide Openeye Name: 3-amino-N-(1,1-dimethylprop-2-ynyl)-4-oxo-4aH-quinazolin-3-ium-2-carboxamide CAS Name: 3-amino-N-(2-methylbut-3-yn-2-yl)-4-oxo-4aH-quinazolin-3-ium-2-carboxamide IUPAC Name: 3-amino-N-(2-methylbut-3-yn-2-yl)-4-oxo-4aH-quinazolin-3-ium-2-carboxamide Traditional Name: 3-amino-N-(1,1-dimethylprop-2-ynyl)-4-keto-4aH-quinazolin-3-ium-2-carboxamide Formula: C14H15N4O2+ MolecularWeight: 271.2945

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#C)NC(=O)C1=[N+](C(=O)C2C=CC=CC2=N1)N

Isomeric SMILES

CC(C)(C#C)NC(=O)C1=[N+](C(=O)C2C=CC=CC2=N1)N

InChI

InChI=1S/C14H14N4O2/c1-4-14(2,3)17-12(19)11-16-10-8-6-5-7-9(10)13(20)18(11)15/h1,5-9H,2-3H3,(H2-,15,17,19)/p+1