5-bromanyl-N2-[4-chloranyl-3-(3-methylbut-2-enoxy)phenyl]pyrimidine-2,4-diamine

Systemtic Name: 5-bromanyl-N2-[4-chloranyl-3-(3-methylbut-2-enoxy)phenyl]pyrimidine-2,4-diamine Openeye Name: 5-bromo-N2-[4-chloro-3-(3-methylbut-2-enoxy)phenyl]pyrimidine-2,4-diamine CAS Name: 5-bromo-N2-[4-chloro-3-(3-methylbut-2-enoxy)phenyl]pyrimidine-2,4-diamine IUPAC Name: 5-bromo-2-N-[4-chloro-3-(3-methylbut-2-enoxy)phenyl]pyrimidine-2,4-diamine Traditional Name: (4-amino-5-bromo-pyrimidin-2-yl)-[4-chloro-3-(3-methylbut-2-enoxy)phenyl]amine Formula: C15H16BrClN4O MolecularWeight: 383.67074

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC1=C(C=CC(=C1)NC2=NC=C(C(=N2)N)Br)Cl)C

Isomeric SMILES

CC(=CCOC1=C(C=CC(=C1)NC2=NC=C(C(=N2)N)Br)Cl)C

InChI

InChI=1S/C15H16BrClN4O/c1-9(2)5-6-22-13-7-10(3-4-12(13)17)20-15-19-8-11(16)14(18)21-15/h3-5,7-8H,6H2,1-2H3,(H3,18,19,20,21)