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

Systemtic Name: N-[6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-yl]quinolin-8-amine Openeye Name: N-[6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-yl]quinolin-8-amine CAS Name: N-[6-(3,5-dimethyl-1-pyrazolyl)-5-nitro-4-pyrimidinyl]-8-quinolinamine IUPAC Name: N-[6-(3,5-dimethylpyrazol-1-yl)-5-nitropyrimidin-4-yl]quinolin-8-amine Traditional Name: [6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-yl]-(8-quinolyl)amine Formula: C18H15N7O2 MolecularWeight: 361.3574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=C(C(=NC=N2)NC3=CC=CC4=C3N=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1C2=C(C(=NC=N2)NC3=CC=CC4=C3N=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C18H15N7O2/c1-11-9-12(2)24(23-11)18-16(25(26)27)17(20-10-21-18)22-14-7-3-5-13-6-4-8-19-15(13)14/h3-10H,1-2H3,(H,20,21,22)