3-nitro-N-(5-oxidanylidene-2-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)benzamide

Systemtic Name: 3-nitro-N-(5-oxidanylidene-2-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)benzamide Openeye Name: N-(2-isopropyl-5-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-3-nitro-benzamide CAS Name: 3-nitro-N-(5-oxo-2-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)benzamide IUPAC Name: 3-nitro-N-(5-oxo-2-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)benzamide Traditional Name: N-(2-isopropyl-5-keto-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-3-nitro-benzamide Formula: C15H14N6O4 MolecularWeight: 342.30946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=NC(=O)C=C(N2N1)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=NC2=NC(=O)C=C(N2N1)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H14N6O4/c1-8(2)13-18-15-17-12(22)7-11(20(15)19-13)16-14(23)9-4-3-5-10(6-9)21(24)25/h3-8H,1-2H3,(H,16,23)(H,17,18,19,22)