6-[5-tert-butyl-2-(4-methylphenyl)sulfonyl-3,4-dihydropyrazol-3-yl]quinoxaline

Systemtic Name: 6-[5-tert-butyl-2-(4-methylphenyl)sulfonyl-3,4-dihydropyrazol-3-yl]quinoxaline Openeye Name: 6-[5-tert-butyl-2-(p-tolylsulfonyl)-3,4-dihydropyrazol-3-yl]quinoxaline CAS Name: 6-[5-tert-butyl-2-(4-methylphenyl)sulfonyl-3,4-dihydropyrazol-3-yl]quinoxaline IUPAC Name: 6-[5-tert-butyl-2-(4-methylphenyl)sulfonyl-3,4-dihydropyrazol-3-yl]quinoxaline Traditional Name: 6-(5-tert-butyl-2-tosyl-2-pyrazolin-3-yl)quinoxaline Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(CC(=N2)C(C)(C)C)C3=CC4=NC=CN=C4C=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(CC(=N2)C(C)(C)C)C3=CC4=NC=CN=C4C=C3

InChI

InChI=1S/C22H24N4O2S/c1-15-5-8-17(9-6-15)29(27,28)26-20(14-21(25-26)22(2,3)4)16-7-10-18-19(13-16)24-12-11-23-18/h5-13,20H,14H2,1-4H3