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

Systemtic Name: 8-bromanyl-5H-pyrrolo[2,1-b][1,3]benzothiazepin-6-one Openeye Name: 8-bromo-5H-pyrrolo[2,1-b][1,3]benzothiazepin-6-one CAS Name: 8-bromo-5H-pyrrolo[2,1-b][1,3]benzothiazepin-6-one IUPAC Name: 8-bromo-5H-pyrrolo[2,1-b][1,3]benzothiazepin-6-one Traditional Name: 8-bromo-5H-pyrrolo[2,1-b][1,3]benzothiazepin-6-one Formula: C12H8BrNOS MolecularWeight: 294.16702

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C2=C(C=CC(=C2)Br)SC3=CC=CN31

Isomeric SMILES

C1C(=O)C2=C(C=CC(=C2)Br)SC3=CC=CN31

InChI

InChI=1S/C12H8BrNOS/c13-8-3-4-11-9(6-8)10(15)7-14-5-1-2-12(14)16-11/h1-6H,7H2