N-butan-2-yl-6-(4-chloranyl-3-methyl-phenoxy)-5-nitro-pyrimidin-4-amine

Systemtic Name: N-butan-2-yl-6-(4-chloranyl-3-methyl-phenoxy)-5-nitro-pyrimidin-4-amine Openeye Name: 6-(4-chloro-3-methyl-phenoxy)-5-nitro-N-sec-butyl-pyrimidin-4-amine CAS Name: N-butan-2-yl-6-(4-chloro-3-methylphenoxy)-5-nitro-4-pyrimidinamine IUPAC Name: N-butan-2-yl-6-(4-chloro-3-methylphenoxy)-5-nitropyrimidin-4-amine Traditional Name: [6-(4-chloro-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]-sec-butyl-amine Formula: C15H17ClN4O3 MolecularWeight: 336.77348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=C(C(=NC=N1)OC2=CC(=C(C=C2)Cl)C)[N+](=O)[O-]

Isomeric SMILES

CCC(C)NC1=C(C(=NC=N1)OC2=CC(=C(C=C2)Cl)C)[N+](=O)[O-]

InChI

InChI=1S/C15H17ClN4O3/c1-4-10(3)19-14-13(20(21)22)15(18-8-17-14)23-11-5-6-12(16)9(2)7-11/h5-8,10H,4H2,1-3H3,(H,17,18,19)