N-[3-[[(2-azanyl-6-chloranyl-pyrimidin-4-yl)amino]methyl]phenyl]-2-methyl-propanamide

Systemtic Name: N-[3-[[(2-azanyl-6-chloranyl-pyrimidin-4-yl)amino]methyl]phenyl]-2-methyl-propanamide Openeye Name: N-[3-[[(2-amino-6-chloro-pyrimidin-4-yl)amino]methyl]phenyl]-2-methyl-propanamide CAS Name: N-[3-[[(2-amino-6-chloro-4-pyrimidinyl)amino]methyl]phenyl]-2-methylpropanamide IUPAC Name: N-[3-[[(2-amino-6-chloropyrimidin-4-yl)amino]methyl]phenyl]-2-methylpropanamide Traditional Name: N-[3-[[(2-amino-6-chloro-pyrimidin-4-yl)amino]methyl]phenyl]-2-methyl-propionamide Formula: C15H18ClN5O MolecularWeight: 319.78932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC(=C1)CNC2=CC(=NC(=N2)N)Cl

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC(=C1)CNC2=CC(=NC(=N2)N)Cl

InChI

InChI=1S/C15H18ClN5O/c1-9(2)14(22)19-11-5-3-4-10(6-11)8-18-13-7-12(16)20-15(17)21-13/h3-7,9H,8H2,1-2H3,(H,19,22)(H3,17,18,20,21)