(2S)-2-(4-chloranyl-3-methyl-phenoxy)-N-[2-(phenylmethyl)pyrazol-3-yl]propanamide

Systemtic Name: (2S)-2-(4-chloranyl-3-methyl-phenoxy)-N-[2-(phenylmethyl)pyrazol-3-yl]propanamide Openeye Name: (2S)-N-(2-benzylpyrazol-3-yl)-2-(4-chloro-3-methyl-phenoxy)propanamide CAS Name: (2S)-2-(4-chloro-3-methylphenoxy)-N-[2-(phenylmethyl)-3-pyrazolyl]propanamide IUPAC Name: (2S)-N-(2-benzylpyrazol-3-yl)-2-(4-chloro-3-methylphenoxy)propanamide Traditional Name: (2S)-N-(2-benzylpyrazol-3-yl)-2-(4-chloro-3-methyl-phenoxy)propionamide Formula: C20H20ClN3O2 MolecularWeight: 369.8447

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC(C)C(=O)NC2=CC=NN2CC3=CC=CC=C3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)O[C@@H](C)C(=O)NC2=CC=NN2CC3=CC=CC=C3)Cl

InChI

InChI=1S/C20H20ClN3O2/c1-14-12-17(8-9-18(14)21)26-15(2)20(25)23-19-10-11-22-24(19)13-16-6-4-3-5-7-16/h3-12,15H,13H2,1-2H3,(H,23,25)/t15-/m0/s1