5H-pyrrolo[2,1-b][1,3]benzothiazepin-6-one

Systemtic Name: 5H-pyrrolo[2,1-b][1,3]benzothiazepin-6-one Openeye Name: 5H-pyrrolo[2,1-b][1,3]benzothiazepin-6-one CAS Name: 5H-pyrrolo[2,1-b][1,3]benzothiazepin-6-one IUPAC Name: 5H-pyrrolo[2,1-b][1,3]benzothiazepin-6-one Traditional Name: 5H-pyrrolo[2,1-b][1,3]benzothiazepin-6-one Formula: C12H9NOS MolecularWeight: 215.27096

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C2=CC=CC=C2SC3=CC=CN31

Isomeric SMILES

C1C(=O)C2=CC=CC=C2SC3=CC=CN31

InChI

InChI=1S/C12H9NOS/c14-10-8-13-7-3-6-12(13)15-11-5-2-1-4-9(10)11/h1-7H,8H2