(6S,7S)-6-methyl-6-oxidanyl-7-phenyl-4-(phenylmethyl)-1,4-thiazepan-3-one

Systemtic Name: (6S,7S)-6-methyl-6-oxidanyl-7-phenyl-4-(phenylmethyl)-1,4-thiazepan-3-one Openeye Name: (6S,7S)-4-benzyl-6-hydroxy-6-methyl-7-phenyl-1,4-thiazepan-3-one CAS Name: (6S,7S)-6-hydroxy-6-methyl-7-phenyl-4-(phenylmethyl)-1,4-thiazepan-3-one IUPAC Name: (6S,7S)-4-benzyl-6-hydroxy-6-methyl-7-phenyl-1,4-thiazepan-3-one Traditional Name: (6S,7S)-4-benzyl-6-hydroxy-6-methyl-7-phenyl-1,4-thiazepan-3-one Formula: C19H21NO2S MolecularWeight: 327.44054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C(=O)CSC1C2=CC=CC=C2)CC3=CC=CC=C3)O

Isomeric SMILES

C[C@@]1(CN(C(=O)CS[C@H]1C2=CC=CC=C2)CC3=CC=CC=C3)O

InChI

InChI=1S/C19H21NO2S/c1-19(22)14-20(12-15-8-4-2-5-9-15)17(21)13-23-18(19)16-10-6-3-7-11-16/h2-11,18,22H,12-14H2,1H3/t18-,19-/m0/s1