5-(1-adamantyl)-N-[(E)-1-naphthalen-1-ylethylideneamino]-1H-pyrazole-3-carboxamide

Systemtic Name: 5-(1-adamantyl)-N-[(E)-1-naphthalen-1-ylethylideneamino]-1H-pyrazole-3-carboxamide Openeye Name: 5-(1-adamantyl)-N-[(E)-1-(1-naphthyl)ethylideneamino]-1H-pyrazole-3-carboxamide CAS Name: 5-(1-adamantyl)-N-[(E)-1-(1-naphthalenyl)ethylideneamino]-1H-pyrazole-3-carboxamide IUPAC Name: 5-(1-adamantyl)-N-[(E)-1-naphthalen-1-ylethylideneamino]-1H-pyrazole-3-carboxamide Traditional Name: 5-(1-adamantyl)-N-[(E)-1-(1-naphthyl)ethylideneamino]-1H-pyrazole-3-carboxamide Formula: C26H28N4O MolecularWeight: 412.52672

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=NNC(=C1)C23CC4CC(C2)CC(C4)C3)C5=CC=CC6=CC=CC=C65

Isomeric SMILES

C/C(=N\NC(=O)C1=NNC(=C1)C23CC4CC(C2)CC(C4)C3)/C5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C26H28N4O/c1-16(21-8-4-6-20-5-2-3-7-22(20)21)27-30-25(31)23-12-24(29-28-23)26-13-17-9-18(14-26)11-19(10-17)15-26/h2-8,12,17-19H,9-11,13-15H2,1H3,(H,28,29)(H,30,31)/b27-16+