3-propan-2-yl-5H-benzo[b][1]benzothiepin-6-one

Systemtic Name: 3-propan-2-yl-5H-benzo[b][1]benzothiepin-6-one Openeye Name: 3-isopropyl-5H-benzo[b][1]benzothiepin-6-one CAS Name: 3-propan-2-yl-5H-benzo[b][1]benzothiepin-6-one IUPAC Name: 3-propan-2-yl-5H-benzo[b][1]benzothiepin-6-one Traditional Name: 3-isopropyl-5H-benzo[b][1]benzothiepin-6-one Formula: C17H16OS MolecularWeight: 268.37334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)SC3=CC=CC=C3C(=O)C2

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)SC3=CC=CC=C3C(=O)C2

InChI

InChI=1S/C17H16OS/c1-11(2)12-7-8-16-13(9-12)10-15(18)14-5-3-4-6-17(14)19-16/h3-9,11H,10H2,1-2H3