5-(1-adamantyl)-N-[(Z)-(4-methylphenyl)methylideneamino]-1H-pyrazole-3-carboxamide

Systemtic Name: 5-(1-adamantyl)-N-[(Z)-(4-methylphenyl)methylideneamino]-1H-pyrazole-3-carboxamide Openeye Name: 5-(1-adamantyl)-N-[(Z)-p-tolylmethyleneamino]-1H-pyrazole-3-carboxamide CAS Name: 5-(1-adamantyl)-N-[(Z)-(4-methylphenyl)methylideneamino]-1H-pyrazole-3-carboxamide IUPAC Name: 5-(1-adamantyl)-N-[(Z)-(4-methylphenyl)methylideneamino]-1H-pyrazole-3-carboxamide Traditional Name: 5-(1-adamantyl)-N-[(Z)-(4-methylbenzylidene)amino]-1H-pyrazole-3-carboxamide Formula: C22H26N4O MolecularWeight: 362.46804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=NNC(=O)C2=NNC(=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC=C(C=C1)/C=N\NC(=O)C2=NNC(=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H26N4O/c1-14-2-4-15(5-3-14)13-23-26-21(27)19-9-20(25-24-19)22-10-16-6-17(11-22)8-18(7-16)12-22/h2-5,9,13,16-18H,6-8,10-12H2,1H3,(H,24,25)(H,26,27)/b23-13-