2-[4-[2,6-dimethyl-4-(1,2,3,4-tetrazol-1-yl)phenyl]sulfonylpiperazin-1-yl]-3-phenyl-quinoxaline

Systemtic Name: 2-[4-[2,6-dimethyl-4-(1,2,3,4-tetrazol-1-yl)phenyl]sulfonylpiperazin-1-yl]-3-phenyl-quinoxaline Openeye Name: 2-[4-[2,6-dimethyl-4-(tetrazol-1-yl)phenyl]sulfonylpiperazin-1-yl]-3-phenyl-quinoxaline CAS Name: 2-[4-[2,6-dimethyl-4-(1-tetrazolyl)phenyl]sulfonyl-1-piperazinyl]-3-phenylquinoxaline IUPAC Name: 2-[4-[2,6-dimethyl-4-(tetrazol-1-yl)phenyl]sulfonylpiperazin-1-yl]-3-phenylquinoxaline Traditional Name: 2-[4-[2,6-dimethyl-4-(tetrazol-1-yl)phenyl]sulfonylpiperazino]-3-phenyl-quinoxaline Formula: C27H26N8O2S MolecularWeight: 526.61274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)N2CCN(CC2)C3=NC4=CC=CC=C4N=C3C5=CC=CC=C5)C)N6C=NN=N6

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)N2CCN(CC2)C3=NC4=CC=CC=C4N=C3C5=CC=CC=C5)C)N6C=NN=N6

InChI

InChI=1S/C27H26N8O2S/c1-19-16-22(35-18-28-31-32-35)17-20(2)26(19)38(36,37)34-14-12-33(13-15-34)27-25(21-8-4-3-5-9-21)29-23-10-6-7-11-24(23)30-27/h3-11,16-18H,12-15H2,1-2H3