2-(5,6-dihydrobenzo[b][1]benzothiepin-3-yl)ethanamide

Systemtic Name: 2-(5,6-dihydrobenzo[b][1]benzothiepin-3-yl)ethanamide Openeye Name: 2-(5,6-dihydrobenzo[b][1]benzothiepin-3-yl)acetamide CAS Name: 2-(5,6-dihydrobenzo[b][1]benzothiepin-3-yl)acetamide IUPAC Name: 2-(5,6-dihydrobenzo[b][1]benzothiepin-3-yl)acetamide Traditional Name: 2-(5,6-dihydrobenzo[b][1]benzothiepin-3-yl)acetamide Formula: C16H15NOS MolecularWeight: 269.3614

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)CC(=O)N)SC3=CC=CC=C31

Isomeric SMILES

C1CC2=C(C=CC(=C2)CC(=O)N)SC3=CC=CC=C31

InChI

InChI=1S/C16H15NOS/c17-16(18)10-11-5-8-15-13(9-11)7-6-12-3-1-2-4-14(12)19-15/h1-5,8-9H,6-7,10H2,(H2,17,18)