2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-(4-methylphenyl)-1H-imidazol-3-ium-4-ol

Systemtic Name: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-(4-methylphenyl)-1H-imidazol-3-ium-4-ol Openeye Name: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-(p-tolyl)-1H-imidazol-3-ium-4-ol CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)amino]-3-(4-methylphenyl)-1H-imidazol-3-ium-4-ol IUPAC Name: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-(4-methylphenyl)-1H-imidazol-3-ium-4-ol Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-(p-tolyl)-1H-imidazol-3-ium-4-ol Formula: C16H18N5O+ MolecularWeight: 296.34702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)[N+]2=C(NC=C2O)NC3=NC(=CC(=N3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)[N+]2=C(NC=C2O)NC3=NC(=CC(=N3)C)C

InChI

InChI=1S/C16H17N5O/c1-10-4-6-13(7-5-10)21-14(22)9-17-16(21)20-15-18-11(2)8-12(3)19-15/h4-9H,1-3H3,(H2,17,18,19,20,22)/p+1