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

Systemtic Name: (2S)-2-phenylsulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide Openeye Name: (2S)-2-phenylsulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide CAS Name: (2S)-2-(phenylthio)-N-(1,3,5-trimethyl-4-pyrazolyl)propanamide IUPAC Name: (2S)-2-phenylsulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide Traditional Name: (2S)-2-(phenylthio)-N-(1,3,5-trimethylpyrazol-4-yl)propionamide Formula: C15H19N3OS MolecularWeight: 289.39586

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N3OS/c1-10-14(11(2)18(4)17-10)16-15(19)12(3)20-13-8-6-5-7-9-13/h5-9,12H,1-4H3,(H,16,19)/t12-/m0/s1