2-(phenylmethyl)-2-(1,2-thiazepan-6-yl)-1,4-oxathiepan-7-one

Systemtic Name: 2-(phenylmethyl)-2-(1,2-thiazepan-6-yl)-1,4-oxathiepan-7-one Openeye Name: 2-benzyl-2-(thiazepan-6-yl)-1,4-oxathiepan-7-one CAS Name: 2-(phenylmethyl)-2-(6-thiazepanyl)-1,4-oxathiepan-7-one IUPAC Name: 2-benzyl-2-(thiazepan-6-yl)-1,4-oxathiepan-7-one Traditional Name: 2-benzyl-2-(thiazepan-6-yl)-1,4-oxathiepan-7-one Formula: C17H23NO2S2 MolecularWeight: 337.50002

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CSNC1)C2(CSCCC(=O)O2)CC3=CC=CC=C3

Isomeric SMILES

C1CC(CSNC1)C2(CSCCC(=O)O2)CC3=CC=CC=C3

InChI

InChI=1S/C17H23NO2S2/c19-16-8-10-21-13-17(20-16,11-14-5-2-1-3-6-14)15-7-4-9-18-22-12-15/h1-3,5-6,15,18H,4,7-13H2