(5S)-N-methyl-5-oxidanyl-3,5-diphenyl-4H-pyrazole-1-carbothioamide

Systemtic Name: (5S)-N-methyl-5-oxidanyl-3,5-diphenyl-4H-pyrazole-1-carbothioamide Openeye Name: (5S)-5-hydroxy-N-methyl-3,5-diphenyl-4H-pyrazole-1-carbothioamide CAS Name: (5S)-5-hydroxy-N-methyl-3,5-diphenyl-4H-pyrazole-1-carbothioamide IUPAC Name: (5S)-5-hydroxy-N-methyl-3,5-diphenyl-4H-pyrazole-1-carbothioamide Traditional Name: (5S)-5-hydroxy-N-methyl-3,5-diphenyl-2-pyrazoline-1-carbothioamide Formula: C17H17N3OS MolecularWeight: 311.40138

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N1C(CC(=N1)C2=CC=CC=C2)(C3=CC=CC=C3)O

Isomeric SMILES

CNC(=S)N1[C@](CC(=N1)C2=CC=CC=C2)(C3=CC=CC=C3)O

InChI

InChI=1S/C17H17N3OS/c1-18-16(22)20-17(21,14-10-6-3-7-11-14)12-15(19-20)13-8-4-2-5-9-13/h2-11,21H,12H2,1H3,(H,18,22)/t17-/m0/s1