2-[3-[(4-methylphenyl)methyl]quinoxalin-2-yl]sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone

Systemtic Name: 2-[3-[(4-methylphenyl)methyl]quinoxalin-2-yl]sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 1-(4-phenylpiperazin-1-yl)-2-[3-(p-tolylmethyl)quinoxalin-2-yl]sulfanyl-ethanone CAS Name: 2-[[3-[(4-methylphenyl)methyl]-2-quinoxalinyl]thio]-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-[3-[(4-methylphenyl)methyl]quinoxalin-2-yl]sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-[[3-(4-methylbenzyl)quinoxalin-2-yl]thio]-1-(4-phenylpiperazino)ethanone Formula: C28H28N4OS MolecularWeight: 468.61312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=NC3=CC=CC=C3N=C2SCC(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)CC2=NC3=CC=CC=C3N=C2SCC(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C28H28N4OS/c1-21-11-13-22(14-12-21)19-26-28(30-25-10-6-5-9-24(25)29-26)34-20-27(33)32-17-15-31(16-18-32)23-7-3-2-4-8-23/h2-14H,15-20H2,1H3