3-(1-adamantyl)-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 3-(1-adamantyl)-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(1-adamantyl)-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(1-adamantyl)-N-[3-(3,5-dimethyl-1-pyrazolyl)propyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(1-adamantyl)-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(1-adamantyl)-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-phenyl-pyrazole-4-carboxamide Formula: C28H35N5O MolecularWeight: 457.6104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCCNC(=O)C2=CN(N=C2C34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6)C

Isomeric SMILES

CC1=CC(=NN1CCCNC(=O)C2=CN(N=C2C34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6)C

InChI

InChI=1S/C28H35N5O/c1-19-11-20(2)32(30-19)10-6-9-29-27(34)25-18-33(24-7-4-3-5-8-24)31-26(25)28-15-21-12-22(16-28)14-23(13-21)17-28/h3-5,7-8,11,18,21-23H,6,9-10,12-17H2,1-2H3,(H,29,34)