5-methyl-N3-(4-methylphenyl)-7-(2-nitrophenyl)-N6-phenyl-1,7-dihydropyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide

Systemtic Name: 5-methyl-N3-(4-methylphenyl)-7-(2-nitrophenyl)-N6-phenyl-1,7-dihydropyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide Openeye Name: 5-methyl-7-(2-nitrophenyl)-N6-phenyl-N3-(p-tolyl)-1,7-dihydropyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide CAS Name: 5-methyl-N3-(4-methylphenyl)-7-(2-nitrophenyl)-N6-phenyl-1,7-dihydropyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide IUPAC Name: 5-methyl-3-N-(4-methylphenyl)-7-(2-nitrophenyl)-6-N-phenyl-1,7-dihydropyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide Traditional Name: 5-methyl-7-(2-nitrophenyl)-N'-phenyl-N-(p-tolyl)-1,7-dihydropyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide Formula: C28H24N6O4 MolecularWeight: 508.52796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=CNN3C2=NC(=C(C3C4=CC=CC=C4[N+](=O)[O-])C(=O)NC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=CNN3C2=NC(=C(C3C4=CC=CC=C4[N+](=O)[O-])C(=O)NC5=CC=CC=C5)C

InChI

InChI=1S/C28H24N6O4/c1-17-12-14-20(15-13-17)31-27(35)22-16-29-33-25(21-10-6-7-11-23(21)34(37)38)24(18(2)30-26(22)33)28(36)32-19-8-4-3-5-9-19/h3-16,25,29H,1-2H3,(H,31,35)(H,32,36)