N-(6-imidazol-1-yl-5-nitro-pyrimidin-4-yl)-2-methyl-quinolin-8-amine

Systemtic Name: N-(6-imidazol-1-yl-5-nitro-pyrimidin-4-yl)-2-methyl-quinolin-8-amine Openeye Name: N-(6-imidazol-1-yl-5-nitro-pyrimidin-4-yl)-2-methyl-quinolin-8-amine CAS Name: N-[6-(1-imidazolyl)-5-nitro-4-pyrimidinyl]-2-methyl-8-quinolinamine IUPAC Name: N-(6-imidazol-1-yl-5-nitropyrimidin-4-yl)-2-methylquinolin-8-amine Traditional Name: (6-imidazol-1-yl-5-nitro-pyrimidin-4-yl)-(2-methyl-8-quinolyl)amine Formula: C17H13N7O2 MolecularWeight: 347.33082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2NC3=NC=NC(=C3[N+](=O)[O-])N4C=CN=C4)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2NC3=NC=NC(=C3[N+](=O)[O-])N4C=CN=C4)C=C1

InChI

InChI=1S/C17H13N7O2/c1-11-5-6-12-3-2-4-13(14(12)21-11)22-16-15(24(25)26)17(20-9-19-16)23-8-7-18-10-23/h2-10H,1H3,(H,19,20,22)