6-[5-(4-methylsulfanylphenyl)-2-(phenylsulfonyl)-3,4-dihydropyrazol-3-yl]quinoxaline

Systemtic Name: 6-[5-(4-methylsulfanylphenyl)-2-(phenylsulfonyl)-3,4-dihydropyrazol-3-yl]quinoxaline Openeye Name: 6-[2-(benzenesulfonyl)-5-(4-methylsulfanylphenyl)-3,4-dihydropyrazol-3-yl]quinoxaline CAS Name: 6-[2-(benzenesulfonyl)-5-[4-(methylthio)phenyl]-3,4-dihydropyrazol-3-yl]quinoxaline IUPAC Name: 6-[2-(benzenesulfonyl)-5-(4-methylsulfanylphenyl)-3,4-dihydropyrazol-3-yl]quinoxaline Traditional Name: 6-[2-besyl-5-[4-(methylthio)phenyl]-2-pyrazolin-3-yl]quinoxaline Formula: C24H20N4O2S2 MolecularWeight: 460.5712

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=NN(C(C2)C3=CC4=NC=CN=C4C=C3)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CSC1=CC=C(C=C1)C2=NN(C(C2)C3=CC4=NC=CN=C4C=C3)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C24H20N4O2S2/c1-31-19-10-7-17(8-11-19)22-16-24(18-9-12-21-23(15-18)26-14-13-25-21)28(27-22)32(29,30)20-5-3-2-4-6-20/h2-15,24H,16H2,1H3