N5-(1-adamantyl)-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide

Systemtic Name: N5-(1-adamantyl)-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide Openeye Name: N5-(1-adamantyl)-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide CAS Name: N5-(1-adamantyl)-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide IUPAC Name: 5-N-(1-adamantyl)-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide Traditional Name: N-(1-adamantyl)-1-phenyl-2-pyrazoline-3,5-dicarboxamide Formula: C21H26N4O2 MolecularWeight: 366.45674

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)C4=NN(C(C4)C(=O)N)C5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)C4=NN(C(C4)C(=O)N)C5=CC=CC=C5

InChI

InChI=1S/C21H26N4O2/c22-19(26)18-9-17(24-25(18)16-4-2-1-3-5-16)20(27)23-21-10-13-6-14(11-21)8-15(7-13)12-21/h1-5,13-15,18H,6-12H2,(H2,22,26)(H,23,27)