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

Systemtic Name: 3-(1-adamantyl)-N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(1-adamantyl)-N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(1-adamantyl)-N-[1-[(3,4-diethoxyphenyl)methyl]-4-pyrazolyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(1-adamantyl)-N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(1-adamantyl)-N-[1-(3,4-diethoxybenzyl)pyrazol-4-yl]-1-phenyl-pyrazole-4-carboxamide Formula: C34H39N5O3 MolecularWeight: 565.70516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN2C=C(C=N2)NC(=O)C3=CN(N=C3C45CC6CC(C4)CC(C6)C5)C7=CC=CC=C7)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN2C=C(C=N2)NC(=O)C3=CN(N=C3C45CC6CC(C4)CC(C6)C5)C7=CC=CC=C7)OCC

InChI

InChI=1S/C34H39N5O3/c1-3-41-30-11-10-23(15-31(30)42-4-2)20-38-21-27(19-35-38)36-33(40)29-22-39(28-8-6-5-7-9-28)37-32(29)34-16-24-12-25(17-34)14-26(13-24)18-34/h5-11,15,19,21-22,24-26H,3-4,12-14,16-18,20H2,1-2H3,(H,36,40)