5-chloranyl-3-methyl-pyridin-2-amine hydrate

Systemtic Name: 5-chloranyl-3-methyl-pyridin-2-amine hydrate Openeye Name: 5-chloro-3-methyl-pyridin-2-amine hydrate CAS Name: 5-chloro-3-methyl-2-pyridinamine hydrate IUPAC Name: 5-chloro-3-methylpyridin-2-amine hydrate Traditional Name: (5-chloro-3-methyl-2-pyridyl)amine hydrate Formula: C12H16Cl2N4O MolecularWeight: 303.18764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CN=C1N)Cl.CC1=CC(=CN=C1N)Cl.O

Isomeric SMILES

CC1=CC(=CN=C1N)Cl.CC1=CC(=CN=C1N)Cl.O

InChI

InChI=1S/2C6H7ClN2.H2O/c2*1-4-2-5(7)3-9-6(4)8;/h2*2-3H,1H3,(H2,8,9);1H2