N-[4-[[6-(2-methylquinolin-8-yl)oxy-5-nitro-pyrimidin-4-yl]amino]phenyl]ethanamide

Systemtic Name: N-[4-[[6-(2-methylquinolin-8-yl)oxy-5-nitro-pyrimidin-4-yl]amino]phenyl]ethanamide Openeye Name: N-[4-[[6-[(2-methyl-8-quinolyl)oxy]-5-nitro-pyrimidin-4-yl]amino]phenyl]acetamide CAS Name: N-[4-[[6-[(2-methyl-8-quinolinyl)oxy]-5-nitro-4-pyrimidinyl]amino]phenyl]acetamide IUPAC Name: N-[4-[[6-(2-methylquinolin-8-yl)oxy-5-nitropyrimidin-4-yl]amino]phenyl]acetamide Traditional Name: N-[4-[[6-[(2-methyl-8-quinolyl)oxy]-5-nitro-pyrimidin-4-yl]amino]phenyl]acetamide Formula: C22H18N6O4 MolecularWeight: 430.41612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OC3=NC=NC(=C3[N+](=O)[O-])NC4=CC=C(C=C4)NC(=O)C)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2OC3=NC=NC(=C3[N+](=O)[O-])NC4=CC=C(C=C4)NC(=O)C)C=C1

InChI

InChI=1S/C22H18N6O4/c1-13-6-7-15-4-3-5-18(19(15)25-13)32-22-20(28(30)31)21(23-12-24-22)27-17-10-8-16(9-11-17)26-14(2)29/h3-12H,1-2H3,(H,26,29)(H,23,24,27)