1-[3-(1,4-thiazepan-4-ylsulfonyl)phenyl]ethanone

Systemtic Name: 1-[3-(1,4-thiazepan-4-ylsulfonyl)phenyl]ethanone Openeye Name: 1-[3-(1,4-thiazepan-4-ylsulfonyl)phenyl]ethanone CAS Name: 1-[3-(1,4-thiazepan-4-ylsulfonyl)phenyl]ethanone IUPAC Name: 1-[3-(1,4-thiazepan-4-ylsulfonyl)phenyl]ethanone Traditional Name: 1-[3-(1,4-thiazepan-4-ylsulfonyl)phenyl]ethanone Formula: C13H17NO3S2 MolecularWeight: 299.40898

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCSCC2

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCSCC2

InChI

InChI=1S/C13H17NO3S2/c1-11(15)12-4-2-5-13(10-12)19(16,17)14-6-3-8-18-9-7-14/h2,4-5,10H,3,6-9H2,1H3