2-[4-(4-butylphenyl)sulfonylpiperazin-1-yl]-3-phenyl-quinoxaline

Systemtic Name: 2-[4-(4-butylphenyl)sulfonylpiperazin-1-yl]-3-phenyl-quinoxaline Openeye Name: 2-[4-(4-butylphenyl)sulfonylpiperazin-1-yl]-3-phenyl-quinoxaline CAS Name: 2-[4-(4-butylphenyl)sulfonyl-1-piperazinyl]-3-phenylquinoxaline IUPAC Name: 2-[4-(4-butylphenyl)sulfonylpiperazin-1-yl]-3-phenylquinoxaline Traditional Name: 2-[4-(4-butylphenyl)sulfonylpiperazino]-3-phenyl-quinoxaline Formula: C28H30N4O2S MolecularWeight: 486.6284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC4=CC=CC=C4N=C3C5=CC=CC=C5

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC4=CC=CC=C4N=C3C5=CC=CC=C5

InChI

InChI=1S/C28H30N4O2S/c1-2-3-9-22-14-16-24(17-15-22)35(33,34)32-20-18-31(19-21-32)28-27(23-10-5-4-6-11-23)29-25-12-7-8-13-26(25)30-28/h4-8,10-17H,2-3,9,18-21H2,1H3