N-(2-adamantyl)-N-butyl-5-methyl-1,3-diphenyl-pyrazole-4-carboxamide

Systemtic Name: N-(2-adamantyl)-N-butyl-5-methyl-1,3-diphenyl-pyrazole-4-carboxamide Openeye Name: N-(2-adamantyl)-N-butyl-5-methyl-1,3-diphenyl-pyrazole-4-carboxamide CAS Name: N-(2-adamantyl)-N-butyl-5-methyl-1,3-diphenyl-4-pyrazolecarboxamide IUPAC Name: N-(2-adamantyl)-N-butyl-5-methyl-1,3-diphenylpyrazole-4-carboxamide Traditional Name: N-(2-adamantyl)-N-butyl-5-methyl-1,3-diphenyl-pyrazole-4-carboxamide Formula: C31H37N3O MolecularWeight: 467.64498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1C2CC3CC(C2)CC1C3)C(=O)C4=C(N(N=C4C5=CC=CC=C5)C6=CC=CC=C6)C

Isomeric SMILES

CCCCN(C1C2CC3CC(C2)CC1C3)C(=O)C4=C(N(N=C4C5=CC=CC=C5)C6=CC=CC=C6)C

InChI

InChI=1S/C31H37N3O/c1-3-4-15-33(30-25-17-22-16-23(19-25)20-26(30)18-22)31(35)28-21(2)34(27-13-9-6-10-14-27)32-29(28)24-11-7-5-8-12-24/h5-14,22-23,25-26,30H,3-4,15-20H2,1-2H3