4-ethanoyl-2,3,4,6-tetrahydro-1,6-benzothiazocin-5-one

Systemtic Name: 4-ethanoyl-2,3,4,6-tetrahydro-1,6-benzothiazocin-5-one Openeye Name: 4-acetyl-2,3,4,6-tetrahydro-1,6-benzothiazocin-5-one CAS Name: 4-acetyl-2,3,4,6-tetrahydro-1,6-benzothiazocin-5-one IUPAC Name: 4-acetyl-2,3,4,6-tetrahydro-1,6-benzothiazocin-5-one Traditional Name: 4-acetyl-2,3,4,6-tetrahydro-1,6-benzothiazocin-5-one Formula: C12H13NO2S MolecularWeight: 235.30212

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1CCSC2=CC=CC=C2NC1=O

Isomeric SMILES

CC(=O)C1CCSC2=CC=CC=C2NC1=O

InChI

InChI=1S/C12H13NO2S/c1-8(14)9-6-7-16-11-5-3-2-4-10(11)13-12(9)15/h2-5,9H,6-7H2,1H3,(H,13,15)