5-bromanyl-N-[2-(2,6-dimethyl-4-pentyl-phenoxy)ethyl]-6-methyl-pyrimidin-4-amine

Systemtic Name: 5-bromanyl-N-[2-(2,6-dimethyl-4-pentyl-phenoxy)ethyl]-6-methyl-pyrimidin-4-amine Openeye Name: 5-bromo-N-[2-(2,6-dimethyl-4-pentyl-phenoxy)ethyl]-6-methyl-pyrimidin-4-amine CAS Name: 5-bromo-N-[2-(2,6-dimethyl-4-pentylphenoxy)ethyl]-6-methyl-4-pyrimidinamine IUPAC Name: 5-bromo-N-[2-(2,6-dimethyl-4-pentylphenoxy)ethyl]-6-methylpyrimidin-4-amine Traditional Name: 2-(4-amyl-2,6-dimethyl-phenoxy)ethyl-(5-bromo-6-methyl-pyrimidin-4-yl)amine Formula: C20H28BrN3O MolecularWeight: 406.35982

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C(=C1)C)OCCNC2=NC=NC(=C2Br)C)C

Isomeric SMILES

CCCCCC1=CC(=C(C(=C1)C)OCCNC2=NC=NC(=C2Br)C)C

InChI

InChI=1S/C20H28BrN3O/c1-5-6-7-8-17-11-14(2)19(15(3)12-17)25-10-9-22-20-18(21)16(4)23-13-24-20/h11-13H,5-10H2,1-4H3,(H,22,23,24)