[azanyl-[(5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)amino]methylidene]-(4,6-dimethylpyrimidin-2-yl)azanium

Systemtic Name: [azanyl-[(5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)amino]methylidene]-(4,6-dimethylpyrimidin-2-yl)azanium Openeye Name: [amino-[(5-oxo-1-phenyl-4H-pyrazol-3-yl)amino]methylene]-(4,6-dimethylpyrimidin-2-yl)ammonium CAS Name: [amino-[(5-oxo-1-phenyl-4H-pyrazol-3-yl)amino]methylidene]-(4,6-dimethyl-2-pyrimidinyl)ammonium IUPAC Name: [amino-[(5-oxo-1-phenyl-4H-pyrazol-3-yl)amino]methylidene]-(4,6-dimethylpyrimidin-2-yl)azanium Traditional Name: [amino-[(5-keto-1-phenyl-2-pyrazolin-3-yl)amino]methylene]-(4,6-dimethylpyrimidin-2-yl)ammonium Formula: C16H18N7O+ MolecularWeight: 324.36042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)[NH+]=C(N)NC2=NN(C(=O)C2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NC(=N1)[NH+]=C(N)NC2=NN(C(=O)C2)C3=CC=CC=C3)C

InChI

InChI=1S/C16H17N7O/c1-10-8-11(2)19-16(18-10)21-15(17)20-13-9-14(24)23(22-13)12-6-4-3-5-7-12/h3-8H,9H2,1-2H3,(H3,17,18,19,20,21,22)/p+1