3,5-dimethyl-N-[(1S)-2-oxidanyl-1-phenyl-ethyl]-1H-pyrazole-4-sulfonamide

Systemtic Name: 3,5-dimethyl-N-[(1S)-2-oxidanyl-1-phenyl-ethyl]-1H-pyrazole-4-sulfonamide Openeye Name: N-[(1S)-2-hydroxy-1-phenyl-ethyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide CAS Name: N-[(1S)-2-hydroxy-1-phenylethyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide IUPAC Name: N-[(1S)-2-hydroxy-1-phenylethyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide Traditional Name: N-[(1S)-2-hydroxy-1-phenyl-ethyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide Formula: C13H17N3O3S MolecularWeight: 295.35738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)S(=O)(=O)NC(CO)C2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=NN1)C)S(=O)(=O)N[C@H](CO)C2=CC=CC=C2

InChI

InChI=1S/C13H17N3O3S/c1-9-13(10(2)15-14-9)20(18,19)16-12(8-17)11-6-4-3-5-7-11/h3-7,12,16-17H,8H2,1-2H3,(H,14,15)/t12-/m1/s1