S-(8-oxidanylidene-8-phenylazanyl-octyl) ethanethioate

Systemtic Name: S-(8-oxidanylidene-8-phenylazanyl-octyl) ethanethioate Openeye Name: S-(8-anilino-8-oxo-octyl) ethanethioate CAS Name: ethanethioic acid S-(8-anilino-8-oxooctyl) ester IUPAC Name: S-(8-anilino-8-oxooctyl) ethanethioate Traditional Name: ethanethioic acid S-(8-anilino-8-keto-octyl) ester Formula: C16H23NO2S MolecularWeight: 293.42432

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCCCCCCC(=O)NC1=CC=CC=C1

Isomeric SMILES

CC(=O)SCCCCCCCC(=O)NC1=CC=CC=C1

InChI

InChI=1S/C16H23NO2S/c1-14(18)20-13-9-4-2-3-8-12-16(19)17-15-10-6-5-7-11-15/h5-7,10-11H,2-4,8-9,12-13H2,1H3,(H,17,19)