1-[4-[4-(2-thiophen-2-ylquinolin-4-yl)carbonylpiperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-(2-thiophen-2-ylquinolin-4-yl)carbonylpiperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-[2-(2-thienyl)quinoline-4-carbonyl]piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[oxo-(2-thiophen-2-yl-4-quinolinyl)methyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-(2-thiophen-2-ylquinoline-4-carbonyl)piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-[2-(2-thienyl)quinoline-4-carbonyl]piperazino]phenyl]ethanone Formula: C26H23N3O2S MolecularWeight: 441.54472

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5

InChI

InChI=1S/C26H23N3O2S/c1-18(30)19-8-10-20(11-9-19)28-12-14-29(15-13-28)26(31)22-17-24(25-7-4-16-32-25)27-23-6-3-2-5-21(22)23/h2-11,16-17H,12-15H2,1H3