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

Systemtic Name: N-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]quinolin-8-amine Openeye Name: N-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]quinolin-8-amine CAS Name: N-[5-nitro-6-(4-phenyl-1-piperazinyl)-4-pyrimidinyl]-8-quinolinamine IUPAC Name: N-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]quinolin-8-amine Traditional Name: [5-nitro-6-(4-phenylpiperazino)pyrimidin-4-yl]-(8-quinolyl)amine Formula: C23H21N7O2 MolecularWeight: 427.45854

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=C(C(=NC=N3)NC4=CC=CC5=C4N=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=C(C(=NC=N3)NC4=CC=CC5=C4N=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H21N7O2/c31-30(32)21-22(27-19-10-4-6-17-7-5-11-24-20(17)19)25-16-26-23(21)29-14-12-28(13-15-29)18-8-2-1-3-9-18/h1-11,16H,12-15H2,(H,25,26,27)