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

Systemtic Name: 3-(1-adamantyl)-N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(1-adamantyl)-N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(1-adamantyl)-N-[1-[(3-methoxyphenyl)methyl]-4-pyrazolyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(1-adamantyl)-N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(1-adamantyl)-N-(1-m-anisylpyrazol-4-yl)-1-phenyl-pyrazole-4-carboxamide Formula: C31H33N5O2 MolecularWeight: 507.62602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2C=C(C=N2)NC(=O)C3=CN(N=C3C45CC6CC(C4)CC(C6)C5)C7=CC=CC=C7

Isomeric SMILES

COC1=CC=CC(=C1)CN2C=C(C=N2)NC(=O)C3=CN(N=C3C45CC6CC(C4)CC(C6)C5)C7=CC=CC=C7

InChI

InChI=1S/C31H33N5O2/c1-38-27-9-5-6-21(13-27)18-35-19-25(17-32-35)33-30(37)28-20-36(26-7-3-2-4-8-26)34-29(28)31-14-22-10-23(15-31)12-24(11-22)16-31/h2-9,13,17,19-20,22-24H,10-12,14-16,18H2,1H3,(H,33,37)