N-(2-adamantyl)-4-chloranyl-5-(2-fluorophenyl)-1-methyl-pyrazole-3-carboxamide

Systemtic Name: N-(2-adamantyl)-4-chloranyl-5-(2-fluorophenyl)-1-methyl-pyrazole-3-carboxamide Openeye Name: N-(2-adamantyl)-4-chloro-5-(2-fluorophenyl)-1-methyl-pyrazole-3-carboxamide CAS Name: N-(2-adamantyl)-4-chloro-5-(2-fluorophenyl)-1-methyl-3-pyrazolecarboxamide IUPAC Name: N-(2-adamantyl)-4-chloro-5-(2-fluorophenyl)-1-methylpyrazole-3-carboxamide Traditional Name: N-(2-adamantyl)-4-chloro-5-(2-fluorophenyl)-1-methyl-pyrazole-3-carboxamide Formula: C21H23ClFN3O MolecularWeight: 387.878223

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C(=O)NC2C3CC4CC(C3)CC2C4)Cl)C5=CC=CC=C5F

Isomeric SMILES

CN1C(=C(C(=N1)C(=O)NC2C3CC4CC(C3)CC2C4)Cl)C5=CC=CC=C5F

InChI

InChI=1S/C21H23ClFN3O/c1-26-20(15-4-2-3-5-16(15)23)17(22)19(25-26)21(27)24-18-13-7-11-6-12(9-13)10-14(18)8-11/h2-5,11-14,18H,6-10H2,1H3,(H,24,27)