6-chloranyl-N-[2-(4-heptyl-2-methyl-phenoxy)ethyl]-5-methyl-pyrimidin-4-amine

Systemtic Name: 6-chloranyl-N-[2-(4-heptyl-2-methyl-phenoxy)ethyl]-5-methyl-pyrimidin-4-amine Openeye Name: 6-chloro-N-[2-(4-heptyl-2-methyl-phenoxy)ethyl]-5-methyl-pyrimidin-4-amine CAS Name: 6-chloro-N-[2-(4-heptyl-2-methylphenoxy)ethyl]-5-methyl-4-pyrimidinamine IUPAC Name: 6-chloro-N-[2-(4-heptyl-2-methylphenoxy)ethyl]-5-methylpyrimidin-4-amine Traditional Name: (6-chloro-5-methyl-pyrimidin-4-yl)-[2-(4-heptyl-2-methyl-phenoxy)ethyl]amine Formula: C21H30ClN3O MolecularWeight: 375.9354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC(=C(C=C1)OCCNC2=C(C(=NC=N2)Cl)C)C

Isomeric SMILES

CCCCCCCC1=CC(=C(C=C1)OCCNC2=C(C(=NC=N2)Cl)C)C

InChI

InChI=1S/C21H30ClN3O/c1-4-5-6-7-8-9-18-10-11-19(16(2)14-18)26-13-12-23-21-17(3)20(22)24-15-25-21/h10-11,14-15H,4-9,12-13H2,1-3H3,(H,23,24,25)