N-[6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-yl]-2-methyl-quinolin-8-amine

Systemtic Name: N-[6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-yl]-2-methyl-quinolin-8-amine Openeye Name: N-[6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-yl]-2-methyl-quinolin-8-amine CAS Name: N-[6-(3,5-dimethyl-1-pyrazolyl)-5-nitro-4-pyrimidinyl]-2-methyl-8-quinolinamine IUPAC Name: N-[6-(3,5-dimethylpyrazol-1-yl)-5-nitropyrimidin-4-yl]-2-methylquinolin-8-amine Traditional Name: [6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-yl]-(2-methyl-8-quinolyl)amine Formula: C19H17N7O2 MolecularWeight: 375.38398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2NC3=NC=NC(=C3[N+](=O)[O-])N4C(=CC(=N4)C)C)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2NC3=NC=NC(=C3[N+](=O)[O-])N4C(=CC(=N4)C)C)C=C1

InChI

InChI=1S/C19H17N7O2/c1-11-7-8-14-5-4-6-15(16(14)22-11)23-18-17(26(27)28)19(21-10-20-18)25-13(3)9-12(2)24-25/h4-10H,1-3H3,(H,20,21,23)