N-(4-methyl-3,5-dinitro-phenyl)-7-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

Systemtic Name: N-(4-methyl-3,5-dinitro-phenyl)-7-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide Openeye Name: N-(4-methyl-3,5-dinitro-phenyl)-7-(p-tolyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide CAS Name: N-(4-methyl-3,5-dinitrophenyl)-7-(4-methylphenyl)-3-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: N-(4-methyl-3,5-dinitrophenyl)-7-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide Traditional Name: N-(4-methyl-3,5-dinitro-phenyl)-7-(p-tolyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide Formula: C21H16N6O5 MolecularWeight: 432.38894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=NC3=C(C=NN23)C(=O)NC4=CC(=C(C(=C4)[N+](=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=NC3=C(C=NN23)C(=O)NC4=CC(=C(C(=C4)[N+](=O)[O-])C)[N+](=O)[O-]

InChI

InChI=1S/C21H16N6O5/c1-12-3-5-14(6-4-12)17-7-8-22-20-16(11-23-25(17)20)21(28)24-15-9-18(26(29)30)13(2)19(10-15)27(31)32/h3-11H,1-2H3,(H,24,28)