3-(1-adamantyl)-N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 3-(1-adamantyl)-N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(1-adamantyl)-N-[3,5-dimethyl-1-(o-tolylmethyl)pyrazol-4-yl]-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(1-adamantyl)-N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]-4-pyrazolyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(1-adamantyl)-N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(1-adamantyl)-N-[3,5-dimethyl-1-(2-methylbenzyl)pyrazol-4-yl]-1-phenyl-pyrazole-4-carboxamide Formula: C33H37N5O MolecularWeight: 519.67978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C(=C(C(=N2)C)NC(=O)C3=CN(N=C3C45CC6CC(C4)CC(C6)C5)C7=CC=CC=C7)C

Isomeric SMILES

CC1=CC=CC=C1CN2C(=C(C(=N2)C)NC(=O)C3=CN(N=C3C45CC6CC(C4)CC(C6)C5)C7=CC=CC=C7)C

InChI

InChI=1S/C33H37N5O/c1-21-9-7-8-10-27(21)19-37-23(3)30(22(2)35-37)34-32(39)29-20-38(28-11-5-4-6-12-28)36-31(29)33-16-24-13-25(17-33)15-26(14-24)18-33/h4-12,20,24-26H,13-19H2,1-3H3,(H,34,39)