(2S)-2-(4-chloranyl-3-methyl-phenoxy)-N-[5-methyl-2-(phenylmethyl)pyrazol-3-yl]propanamide

Systemtic Name: (2S)-2-(4-chloranyl-3-methyl-phenoxy)-N-[5-methyl-2-(phenylmethyl)pyrazol-3-yl]propanamide Openeye Name: (2S)-N-(2-benzyl-5-methyl-pyrazol-3-yl)-2-(4-chloro-3-methyl-phenoxy)propanamide CAS Name: (2S)-2-(4-chloro-3-methylphenoxy)-N-[5-methyl-2-(phenylmethyl)-3-pyrazolyl]propanamide IUPAC Name: (2S)-N-(2-benzyl-5-methylpyrazol-3-yl)-2-(4-chloro-3-methylphenoxy)propanamide Traditional Name: (2S)-N-(2-benzyl-5-methyl-pyrazol-3-yl)-2-(4-chloro-3-methyl-phenoxy)propionamide Formula: C21H22ClN3O2 MolecularWeight: 383.87128

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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)C)Cl

Isomeric SMILES

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

InChI

InChI=1S/C21H22ClN3O2/c1-14-11-18(9-10-19(14)22)27-16(3)21(26)23-20-12-15(2)24-25(20)13-17-7-5-4-6-8-17/h4-12,16H,13H2,1-3H3,(H,23,26)/t16-/m0/s1