(2S,3R)-3-[(1R)-1-oxidanylethyl]-2-phenethyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one

Systemtic Name: (2S,3R)-3-[(1R)-1-oxidanylethyl]-2-phenethyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one Openeye Name: (2S,3R)-3-[(1R)-1-hydroxyethyl]-2-phenethyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one CAS Name: (2S,3R)-3-[(1R)-1-hydroxyethyl]-2-phenethyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one IUPAC Name: (2S,3R)-3-[(1R)-1-hydroxyethyl]-2-phenethyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one Traditional Name: (2S,3R)-3-[(1R)-1-hydroxyethyl]-2-phenethyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one Formula: C19H21NO2S MolecularWeight: 327.44054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C(SC2=CC=CC=C2NC1=O)CCC3=CC=CC=C3)O

Isomeric SMILES

C[C@H]([C@H]1[C@@H](SC2=CC=CC=C2NC1=O)CCC3=CC=CC=C3)O

InChI

InChI=1S/C19H21NO2S/c1-13(21)18-17(12-11-14-7-3-2-4-8-14)23-16-10-6-5-9-15(16)20-19(18)22/h2-10,13,17-18,21H,11-12H2,1H3,(H,20,22)/t13-,17+,18+/m1/s1