(2S)-N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]-2-ethyl-hexanamide

Systemtic Name: (2S)-N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]-2-ethyl-hexanamide Openeye Name: (2S)-N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]-2-ethyl-hexanamide CAS Name: (2S)-N-[5-tert-butyl-2-(2-chlorophenyl)-3-pyrazolyl]-2-ethylhexanamide IUPAC Name: (2S)-N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]-2-ethylhexanamide Traditional Name: (2S)-N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]-2-ethyl-hexanamide Formula: C21H30ClN3O MolecularWeight: 375.9354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1=CC(=NN1C2=CC=CC=C2Cl)C(C)(C)C

Isomeric SMILES

CCCC[C@H](CC)C(=O)NC1=CC(=NN1C2=CC=CC=C2Cl)C(C)(C)C

InChI

InChI=1S/C21H30ClN3O/c1-6-8-11-15(7-2)20(26)23-19-14-18(21(3,4)5)24-25(19)17-13-10-9-12-16(17)22/h9-10,12-15H,6-8,11H2,1-5H3,(H,23,26)/t15-/m0/s1