9-butylsulfanyl-5H-benzo[b][1,4]benzoxazepin-6-one

Systemtic Name: 9-butylsulfanyl-5H-benzo[b][1,4]benzoxazepin-6-one Openeye Name: 9-butylsulfanyl-5H-benzo[b][1,4]benzoxazepin-6-one CAS Name: 9-(butylthio)-5H-benzo[b][1,4]benzoxazepin-6-one IUPAC Name: 9-butylsulfanyl-5H-benzo[b][1,4]benzoxazepin-6-one Traditional Name: 9-(butylthio)-5H-benzo[b][1,4]benzoxazepin-6-one Formula: C17H17NO2S MolecularWeight: 299.38738

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC2=C(C=C1)C(=O)NC3=CC=CC=C3O2

Isomeric SMILES

CCCCSC1=CC2=C(C=C1)C(=O)NC3=CC=CC=C3O2

InChI

InChI=1S/C17H17NO2S/c1-2-3-10-21-12-8-9-13-16(11-12)20-15-7-5-4-6-14(15)18-17(13)19/h4-9,11H,2-3,10H2,1H3,(H,18,19)