N-[(2-chlorophenyl)methyl]-6-(2-methylquinolin-8-yl)oxy-5-nitro-pyrimidin-4-amine

Systemtic Name: N-[(2-chlorophenyl)methyl]-6-(2-methylquinolin-8-yl)oxy-5-nitro-pyrimidin-4-amine Openeye Name: N-[(2-chlorophenyl)methyl]-6-[(2-methyl-8-quinolyl)oxy]-5-nitro-pyrimidin-4-amine CAS Name: N-[(2-chlorophenyl)methyl]-6-[(2-methyl-8-quinolinyl)oxy]-5-nitro-4-pyrimidinamine IUPAC Name: N-[(2-chlorophenyl)methyl]-6-(2-methylquinolin-8-yl)oxy-5-nitropyrimidin-4-amine Traditional Name: (2-chlorobenzyl)-[6-[(2-methyl-8-quinolyl)oxy]-5-nitro-pyrimidin-4-yl]amine Formula: C21H16ClN5O3 MolecularWeight: 421.83644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OC3=NC=NC(=C3[N+](=O)[O-])NCC4=CC=CC=C4Cl)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2OC3=NC=NC(=C3[N+](=O)[O-])NCC4=CC=CC=C4Cl)C=C1

InChI

InChI=1S/C21H16ClN5O3/c1-13-9-10-14-6-4-8-17(18(14)26-13)30-21-19(27(28)29)20(24-12-25-21)23-11-15-5-2-3-7-16(15)22/h2-10,12H,11H2,1H3,(H,23,24,25)