(5-nitrothiophen-2-yl)-[4-(2-phenylquinolin-4-yl)carbonylpiperazin-1-yl]methanone

Systemtic Name: (5-nitrothiophen-2-yl)-[4-(2-phenylquinolin-4-yl)carbonylpiperazin-1-yl]methanone Openeye Name: (5-nitro-2-thienyl)-[4-(2-phenylquinoline-4-carbonyl)piperazin-1-yl]methanone CAS Name: (5-nitro-2-thiophenyl)-[4-[oxo-(2-phenyl-4-quinolinyl)methyl]-1-piperazinyl]methanone IUPAC Name: (5-nitrothiophen-2-yl)-[4-(2-phenylquinoline-4-carbonyl)piperazin-1-yl]methanone Traditional Name: (5-nitro-2-thienyl)-[4-(2-phenylquinoline-4-carbonyl)piperazino]methanone Formula: C25H20N4O4S MolecularWeight: 472.5157

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(S2)[N+](=O)[O-])C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(S2)[N+](=O)[O-])C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C25H20N4O4S/c30-24(27-12-14-28(15-13-27)25(31)22-10-11-23(34-22)29(32)33)19-16-21(17-6-2-1-3-7-17)26-20-9-5-4-8-18(19)20/h1-11,16H,12-15H2