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

Systemtic Name: 3-(1-adamantyl)-N-[1-[(2,4-dimethylphenoxy)methyl]pyrazol-4-yl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(1-adamantyl)-N-[1-[(2,4-dimethylphenoxy)methyl]pyrazol-4-yl]-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(1-adamantyl)-N-[1-[(2,4-dimethylphenoxy)methyl]-4-pyrazolyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(1-adamantyl)-N-[1-[(2,4-dimethylphenoxy)methyl]pyrazol-4-yl]-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(1-adamantyl)-N-[1-[(2,4-dimethylphenoxy)methyl]pyrazol-4-yl]-1-phenyl-pyrazole-4-carboxamide Formula: C32H35N5O2 MolecularWeight: 521.6526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCN2C=C(C=N2)NC(=O)C3=CN(N=C3C45CC6CC(C4)CC(C6)C5)C7=CC=CC=C7)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCN2C=C(C=N2)NC(=O)C3=CN(N=C3C45CC6CC(C4)CC(C6)C5)C7=CC=CC=C7)C

InChI

InChI=1S/C32H35N5O2/c1-21-8-9-29(22(2)10-21)39-20-36-18-26(17-33-36)34-31(38)28-19-37(27-6-4-3-5-7-27)35-30(28)32-14-23-11-24(15-32)13-25(12-23)16-32/h3-10,17-19,23-25H,11-16,20H2,1-2H3,(H,34,38)