N-[3-(4-chloranyl-2-cyclohexyl-phenoxy)-5-nitro-phenyl]-7-methyl-5-phenyl-pyrazolo[1,5-a]pyrimidine-2-carboxamide

Systemtic Name: N-[3-(4-chloranyl-2-cyclohexyl-phenoxy)-5-nitro-phenyl]-7-methyl-5-phenyl-pyrazolo[1,5-a]pyrimidine-2-carboxamide Openeye Name: N-[3-(4-chloro-2-cyclohexyl-phenoxy)-5-nitro-phenyl]-7-methyl-5-phenyl-pyrazolo[1,5-a]pyrimidine-2-carboxamide CAS Name: N-[3-(4-chloro-2-cyclohexylphenoxy)-5-nitrophenyl]-7-methyl-5-phenyl-2-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: N-[3-(4-chloro-2-cyclohexylphenoxy)-5-nitrophenyl]-7-methyl-5-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide Traditional Name: N-[3-(4-chloro-2-cyclohexyl-phenoxy)-5-nitro-phenyl]-7-methyl-5-phenyl-pyrazolo[1,5-a]pyrimidine-2-carboxamide Formula: C32H28ClN5O4 MolecularWeight: 582.04882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC(=NN12)C(=O)NC3=CC(=CC(=C3)OC4=C(C=C(C=C4)Cl)C5CCCCC5)[N+](=O)[O-])C6=CC=CC=C6

Isomeric SMILES

CC1=CC(=NC2=CC(=NN12)C(=O)NC3=CC(=CC(=C3)OC4=C(C=C(C=C4)Cl)C5CCCCC5)[N+](=O)[O-])C6=CC=CC=C6

InChI

InChI=1S/C32H28ClN5O4/c1-20-14-28(22-10-6-3-7-11-22)35-31-19-29(36-37(20)31)32(39)34-24-16-25(38(40)41)18-26(17-24)42-30-13-12-23(33)15-27(30)21-8-4-2-5-9-21/h3,6-7,10-19,21H,2,4-5,8-9H2,1H3,(H,34,39)