1-(4-phenylpiperazin-1-yl)-2-(3-piperidin-1-ylquinoxalin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(4-phenylpiperazin-1-yl)-2-(3-piperidin-1-ylquinoxalin-2-yl)sulfanyl-ethanone Openeye Name: 1-(4-phenylpiperazin-1-yl)-2-[3-(1-piperidyl)quinoxalin-2-yl]sulfanyl-ethanone CAS Name: 1-(4-phenyl-1-piperazinyl)-2-[[3-(1-piperidinyl)-2-quinoxalinyl]thio]ethanone IUPAC Name: 1-(4-phenylpiperazin-1-yl)-2-(3-piperidin-1-ylquinoxalin-2-yl)sulfanylethanone Traditional Name: 1-(4-phenylpiperazino)-2-[(3-piperidinoquinoxalin-2-yl)thio]ethanone Formula: C25H29N5OS MolecularWeight: 447.59566

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC3=CC=CC=C3N=C2SCC(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)C2=NC3=CC=CC=C3N=C2SCC(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C25H29N5OS/c31-23(29-17-15-28(16-18-29)20-9-3-1-4-10-20)19-32-25-24(30-13-7-2-8-14-30)26-21-11-5-6-12-22(21)27-25/h1,3-6,9-12H,2,7-8,13-19H2