1-(6,6-dimethyl-1,4-thiazepan-4-yl)hexan-1-one

Systemtic Name: 1-(6,6-dimethyl-1,4-thiazepan-4-yl)hexan-1-one Openeye Name: 1-(6,6-dimethyl-1,4-thiazepan-4-yl)hexan-1-one CAS Name: 1-(6,6-dimethyl-1,4-thiazepan-4-yl)-1-hexanone IUPAC Name: 1-(6,6-dimethyl-1,4-thiazepan-4-yl)hexan-1-one Traditional Name: 1-(6,6-dimethyl-1,4-thiazepan-4-yl)hexan-1-one Formula: C13H25NOS MolecularWeight: 243.4087

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N1CCSCC(C1)(C)C

Isomeric SMILES

CCCCCC(=O)N1CCSCC(C1)(C)C

InChI

InChI=1S/C13H25NOS/c1-4-5-6-7-12(15)14-8-9-16-11-13(2,3)10-14/h4-11H2,1-3H3