S-(2-azanyl-6-phenoxy-hexyl) ethanethioate

Systemtic Name: S-(2-azanyl-6-phenoxy-hexyl) ethanethioate Openeye Name: S-(2-amino-6-phenoxy-hexyl) ethanethioate CAS Name: ethanethioic acid S-(2-amino-6-phenoxyhexyl) ester IUPAC Name: S-(2-amino-6-phenoxyhexyl) ethanethioate Traditional Name: ethanethioic acid S-(2-amino-6-phenoxy-hexyl) ester Formula: C14H21NO2S MolecularWeight: 267.38704

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(CCCCOC1=CC=CC=C1)N

Isomeric SMILES

CC(=O)SCC(CCCCOC1=CC=CC=C1)N

InChI

InChI=1S/C14H21NO2S/c1-12(16)18-11-13(15)7-5-6-10-17-14-8-3-2-4-9-14/h2-4,8-9,13H,5-7,10-11,15H2,1H3