(2S)-2-(4-bromophenyl)sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide

Systemtic Name: (2S)-2-(4-bromophenyl)sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide Openeye Name: (2S)-2-(4-bromophenyl)sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide CAS Name: (2S)-2-[(4-bromophenyl)thio]-N-(1,3,5-trimethyl-4-pyrazolyl)propanamide IUPAC Name: (2S)-2-(4-bromophenyl)sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide Traditional Name: (2S)-2-[(4-bromophenyl)thio]-N-(1,3,5-trimethylpyrazol-4-yl)propionamide Formula: C15H18BrN3OS MolecularWeight: 368.29192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=O)C(C)SC2=CC=C(C=C2)Br

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=O)[C@H](C)SC2=CC=C(C=C2)Br

InChI

InChI=1S/C15H18BrN3OS/c1-9-14(10(2)19(4)18-9)17-15(20)11(3)21-13-7-5-12(16)6-8-13/h5-8,11H,1-4H3,(H,17,20)/t11-/m0/s1