S-(6-oxidanylidene-6-phenylazanyl-hexyl) ethanethioate

Systemtic Name: S-(6-oxidanylidene-6-phenylazanyl-hexyl) ethanethioate Openeye Name: S-(6-anilino-6-oxo-hexyl) ethanethioate CAS Name: ethanethioic acid S-(6-anilino-6-oxohexyl) ester IUPAC Name: S-(6-anilino-6-oxohexyl) ethanethioate Traditional Name: ethanethioic acid S-(6-anilino-6-keto-hexyl) ester Formula: C14H19NO2S MolecularWeight: 265.37116

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCCCCC(=O)NC1=CC=CC=C1

Isomeric SMILES

CC(=O)SCCCCCC(=O)NC1=CC=CC=C1

InChI

InChI=1S/C14H19NO2S/c1-12(16)18-11-7-3-6-10-14(17)15-13-8-4-2-5-9-13/h2,4-5,8-9H,3,6-7,10-11H2,1H3,(H,15,17)