(2S)-2-(4-bromanyl-2-chloranyl-phenoxy)-N-(1,3,5-trimethylpyrazol-4-yl)propanamide

Systemtic Name: (2S)-2-(4-bromanyl-2-chloranyl-phenoxy)-N-(1,3,5-trimethylpyrazol-4-yl)propanamide Openeye Name: (2S)-2-(4-bromo-2-chloro-phenoxy)-N-(1,3,5-trimethylpyrazol-4-yl)propanamide CAS Name: (2S)-2-(4-bromo-2-chlorophenoxy)-N-(1,3,5-trimethyl-4-pyrazolyl)propanamide IUPAC Name: (2S)-2-(4-bromo-2-chlorophenoxy)-N-(1,3,5-trimethylpyrazol-4-yl)propanamide Traditional Name: (2S)-2-(4-bromo-2-chloro-phenoxy)-N-(1,3,5-trimethylpyrazol-4-yl)propionamide Formula: C15H17BrClN3O2 MolecularWeight: 386.67138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=O)C(C)OC2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=O)[C@H](C)OC2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C15H17BrClN3O2/c1-8-14(9(2)20(4)19-8)18-15(21)10(3)22-13-6-5-11(16)7-12(13)17/h5-7,10H,1-4H3,(H,18,21)/t10-/m0/s1