2,3,4,4a,5,11a-hexahydro-1H-benzo[b][1,4]benzothiazepin-6-one

Systemtic Name: 2,3,4,4a,5,11a-hexahydro-1H-benzo[b][1,4]benzothiazepin-6-one Openeye Name: 2,3,4,4a,5,11a-hexahydro-1H-benzo[b][1,4]benzothiazepin-6-one CAS Name: 2,3,4,4a,5,11a-hexahydro-1H-benzo[b][1,4]benzothiazepin-6-one IUPAC Name: 2,3,4,4a,5,11a-hexahydro-1H-benzo[b][1,4]benzothiazepin-6-one Traditional Name: 2,3,4,4a,5,11a-hexahydro-1H-benzo[b][1,4]benzothiazepin-6-one Formula: C13H15NOS MolecularWeight: 233.3293

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2C(C1)NC(=O)C3=CC=CC=C3S2

Isomeric SMILES

C1CCC2C(C1)NC(=O)C3=CC=CC=C3S2

InChI

InChI=1S/C13H15NOS/c15-13-9-5-1-3-7-11(9)16-12-8-4-2-6-10(12)14-13/h1,3,5,7,10,12H,2,4,6,8H2,(H,14,15)