S-[1-(2-chlorophenyl)ethyl] azepane-1-carbothioate

Systemtic Name: S-[1-(2-chlorophenyl)ethyl] azepane-1-carbothioate Openeye Name: S-[1-(2-chlorophenyl)ethyl] azepane-1-carbothioate CAS Name: 1-azepanecarbothioic acid S-[1-(2-chlorophenyl)ethyl] ester IUPAC Name: S-[1-(2-chlorophenyl)ethyl] azepane-1-carbothioate Traditional Name: azepane-1-carbothioic acid S-[1-(2-chlorophenyl)ethyl] ester Formula: C15H20ClNOS MolecularWeight: 297.8434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Cl)SC(=O)N2CCCCCC2

Isomeric SMILES

CC(C1=CC=CC=C1Cl)SC(=O)N2CCCCCC2

InChI

InChI=1S/C15H20ClNOS/c1-12(13-8-4-5-9-14(13)16)19-15(18)17-10-6-2-3-7-11-17/h4-5,8-9,12H,2-3,6-7,10-11H2,1H3