4-tert-butyl-N-[2-methyl-4-(4-methylphenyl)-5-[2-(5-nitropyrimidin-2-yl)oxyethoxy]pyrazol-3-yl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[2-methyl-4-(4-methylphenyl)-5-[2-(5-nitropyrimidin-2-yl)oxyethoxy]pyrazol-3-yl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[2-methyl-5-[2-(5-nitropyrimidin-2-yl)oxyethoxy]-4-(p-tolyl)pyrazol-3-yl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[2-methyl-4-(4-methylphenyl)-5-[2-[(5-nitro-2-pyrimidinyl)oxy]ethoxy]-3-pyrazolyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[2-methyl-4-(4-methylphenyl)-5-[2-(5-nitropyrimidin-2-yl)oxyethoxy]pyrazol-3-yl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[2-methyl-5-[2-(5-nitropyrimidin-2-yl)oxyethoxy]-4-(p-tolyl)pyrazol-3-yl]benzenesulfonamide Formula: C27H30N6O6S MolecularWeight: 566.6287

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N(N=C2OCCOC3=NC=C(C=N3)[N+](=O)[O-])C)NS(=O)(=O)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N(N=C2OCCOC3=NC=C(C=N3)[N+](=O)[O-])C)NS(=O)(=O)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C27H30N6O6S/c1-18-6-8-19(9-7-18)23-24(31-40(36,37)22-12-10-20(11-13-22)27(2,3)4)32(5)30-25(23)38-14-15-39-26-28-16-21(17-29-26)33(34)35/h6-13,16-17,31H,14-15H2,1-5H3