sodium 4-(2-chloranylpyridin-4-yl)-N-(3-methylphenyl)pyrimidin-2-amine hydroxide

Systemtic Name: sodium 4-(2-chloranylpyridin-4-yl)-N-(3-methylphenyl)pyrimidin-2-amine hydroxide Openeye Name: sodium 4-(2-chloro-4-pyridyl)-N-(m-tolyl)pyrimidin-2-amine hydroxide CAS Name: sodium 4-(2-chloro-4-pyridinyl)-N-(3-methylphenyl)-2-pyrimidinamine hydroxide IUPAC Name: sodium 4-(2-chloropyridin-4-yl)-N-(3-methylphenyl)pyrimidin-2-amine hydroxide Traditional Name: sodium [4-(2-chloro-4-pyridyl)pyrimidin-2-yl]-(m-tolyl)amine hydroxide Formula: C16H14ClN4NaO MolecularWeight: 336.75133

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC=CC(=N2)C3=CC(=NC=C3)Cl.[OH-].[Na+]

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC=CC(=N2)C3=CC(=NC=C3)Cl.[OH-].[Na+]

InChI

InChI=1S/C16H13ClN4.Na.H2O/c1-11-3-2-4-13(9-11)20-16-19-8-6-14(21-16)12-5-7-18-15(17)10-12;;/h2-10H,1H3,(H,19,20,21);;1H2/q;+1;/p-1