5-(1-adamantyl)-N-[(Z)-1-naphthalen-2-ylethylideneamino]-1H-pyrazole-3-carboxamide

Systemtic Name: 5-(1-adamantyl)-N-[(Z)-1-naphthalen-2-ylethylideneamino]-1H-pyrazole-3-carboxamide Openeye Name: 5-(1-adamantyl)-N-[(Z)-1-(2-naphthyl)ethylideneamino]-1H-pyrazole-3-carboxamide CAS Name: 5-(1-adamantyl)-N-[(Z)-1-(2-naphthalenyl)ethylideneamino]-1H-pyrazole-3-carboxamide IUPAC Name: 5-(1-adamantyl)-N-[(Z)-1-naphthalen-2-ylethylideneamino]-1H-pyrazole-3-carboxamide Traditional Name: 5-(1-adamantyl)-N-[(Z)-1-(2-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=CC6=CC=CC=C6C=C5

Isomeric SMILES

C/C(=N/NC(=O)C1=NNC(=C1)C23CC4CC(C2)CC(C4)C3)/C5=CC6=CC=CC=C6C=C5

InChI

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