3-(1-adamantyl)-N-[(2-methylpyrazol-3-yl)methyl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 3-(1-adamantyl)-N-[(2-methylpyrazol-3-yl)methyl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(1-adamantyl)-N-[(2-methylpyrazol-3-yl)methyl]-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(1-adamantyl)-N-[(2-methyl-3-pyrazolyl)methyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(1-adamantyl)-N-[(2-methylpyrazol-3-yl)methyl]-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(1-adamantyl)-N-[(2-methylpyrazol-3-yl)methyl]-1-phenyl-pyrazole-4-carboxamide Formula: C25H29N5O MolecularWeight: 415.53066

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)CNC(=O)C2=CN(N=C2C34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6

Isomeric SMILES

CN1C(=CC=N1)CNC(=O)C2=CN(N=C2C34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6

InChI

InChI=1S/C25H29N5O/c1-29-21(7-8-27-29)15-26-24(31)22-16-30(20-5-3-2-4-6-20)28-23(22)25-12-17-9-18(13-25)11-19(10-17)14-25/h2-8,16-19H,9-15H2,1H3,(H,26,31)