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

Systemtic Name: N-[2-(4-butyl-2-methyl-6-nitro-phenoxy)ethyl]-5-chloranyl-6-methyl-pyrimidin-4-amine Openeye Name: N-[2-(4-butyl-2-methyl-6-nitro-phenoxy)ethyl]-5-chloro-6-methyl-pyrimidin-4-amine CAS Name: N-[2-(4-butyl-2-methyl-6-nitrophenoxy)ethyl]-5-chloro-6-methyl-4-pyrimidinamine IUPAC Name: N-[2-(4-butyl-2-methyl-6-nitrophenoxy)ethyl]-5-chloro-6-methylpyrimidin-4-amine Traditional Name: 2-(4-butyl-2-methyl-6-nitro-phenoxy)ethyl-(5-chloro-6-methyl-pyrimidin-4-yl)amine Formula: C18H23ClN4O3 MolecularWeight: 378.85322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C(=C1)[N+](=O)[O-])OCCNC2=NC=NC(=C2Cl)C)C

Isomeric SMILES

CCCCC1=CC(=C(C(=C1)[N+](=O)[O-])OCCNC2=NC=NC(=C2Cl)C)C

InChI

InChI=1S/C18H23ClN4O3/c1-4-5-6-14-9-12(2)17(15(10-14)23(24)25)26-8-7-20-18-16(19)13(3)21-11-22-18/h9-11H,4-8H2,1-3H3,(H,20,21,22)