5-bromanyl-N-[3-(4-butyl-2-methyl-phenoxy)propyl]-6-methyl-pyrimidin-4-amine

Systemtic Name: 5-bromanyl-N-[3-(4-butyl-2-methyl-phenoxy)propyl]-6-methyl-pyrimidin-4-amine Openeye Name: 5-bromo-N-[3-(4-butyl-2-methyl-phenoxy)propyl]-6-methyl-pyrimidin-4-amine CAS Name: 5-bromo-N-[3-(4-butyl-2-methylphenoxy)propyl]-6-methyl-4-pyrimidinamine IUPAC Name: 5-bromo-N-[3-(4-butyl-2-methylphenoxy)propyl]-6-methylpyrimidin-4-amine Traditional Name: (5-bromo-6-methyl-pyrimidin-4-yl)-[3-(4-butyl-2-methyl-phenoxy)propyl]amine Formula: C19H26BrN3O MolecularWeight: 392.33324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)OCCCNC2=NC=NC(=C2Br)C)C

Isomeric SMILES

CCCCC1=CC(=C(C=C1)OCCCNC2=NC=NC(=C2Br)C)C

InChI

InChI=1S/C19H26BrN3O/c1-4-5-7-16-8-9-17(14(2)12-16)24-11-6-10-21-19-18(20)15(3)22-13-23-19/h8-9,12-13H,4-7,10-11H2,1-3H3,(H,21,22,23)