2-chloranyl-N-(2,2-dimethylpropyl)-5-[[(4-methoxyphenyl)methylamino]methyl]pyrimidin-4-amine

Systemtic Name: 2-chloranyl-N-(2,2-dimethylpropyl)-5-[[(4-methoxyphenyl)methylamino]methyl]pyrimidin-4-amine Openeye Name: 2-chloro-N-(2,2-dimethylpropyl)-5-[[(4-methoxyphenyl)methylamino]methyl]pyrimidin-4-amine CAS Name: 2-chloro-N-(2,2-dimethylpropyl)-5-[[(4-methoxyphenyl)methylamino]methyl]-4-pyrimidinamine IUPAC Name: 2-chloro-N-(2,2-dimethylpropyl)-5-[[(4-methoxyphenyl)methylamino]methyl]pyrimidin-4-amine Traditional Name: [2-chloro-4-(neopentylamino)pyrimidin-5-yl]methyl-p-anisyl-amine Formula: C18H25ClN4O MolecularWeight: 348.8703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CNC1=NC(=NC=C1CNCC2=CC=C(C=C2)OC)Cl

Isomeric SMILES

CC(C)(C)CNC1=NC(=NC=C1CNCC2=CC=C(C=C2)OC)Cl

InChI

InChI=1S/C18H25ClN4O/c1-18(2,3)12-22-16-14(11-21-17(19)23-16)10-20-9-13-5-7-15(24-4)8-6-13/h5-8,11,20H,9-10,12H2,1-4H3,(H,21,22,23)