N-[(1R,3S)-3-oxidanyl-1-phenyl-butyl]benzenecarbothioamide

Systemtic Name: N-[(1R,3S)-3-oxidanyl-1-phenyl-butyl]benzenecarbothioamide Openeye Name: N-[(1R,3S)-3-hydroxy-1-phenyl-butyl]benzenecarbothioamide CAS Name: N-[(1R,3S)-3-hydroxy-1-phenylbutyl]benzenecarbothioamide IUPAC Name: N-[(1R,3S)-3-hydroxy-1-phenylbutyl]benzenecarbothioamide Traditional Name: N-[(1R,3S)-3-hydroxy-1-phenyl-butyl]thiobenzamide Formula: C17H19NOS MolecularWeight: 285.40386

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C1=CC=CC=C1)NC(=S)C2=CC=CC=C2)O

Isomeric SMILES

C[C@@H](C[C@H](C1=CC=CC=C1)NC(=S)C2=CC=CC=C2)O

InChI

InChI=1S/C17H19NOS/c1-13(19)12-16(14-8-4-2-5-9-14)18-17(20)15-10-6-3-7-11-15/h2-11,13,16,19H,12H2,1H3,(H,18,20)/t13-,16+/m0/s1