2-methyl-N-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]quinolin-5-amine

Systemtic Name: 2-methyl-N-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]quinolin-5-amine Openeye Name: N-[6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-yl]-2-methyl-quinolin-5-amine CAS Name: 2-methyl-N-[5-nitro-6-(4-propan-2-ylphenoxy)-4-pyrimidinyl]-5-quinolinamine IUPAC Name: 2-methyl-N-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]quinolin-5-amine Traditional Name: [6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-yl]-(2-methyl-5-quinolyl)amine Formula: C23H21N5O3 MolecularWeight: 415.44454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=CC=C2)NC3=C(C(=NC=N3)OC4=CC=C(C=C4)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=C(C=C1)C(=CC=C2)NC3=C(C(=NC=N3)OC4=CC=C(C=C4)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C23H21N5O3/c1-14(2)16-8-10-17(11-9-16)31-23-21(28(29)30)22(24-13-25-23)27-20-6-4-5-19-18(20)12-7-15(3)26-19/h4-14H,1-3H3,(H,24,25,27)