6-chloranyl-2-sulfanylidene-1H-4,1-benzoxazepin-5-one

Systemtic Name: 6-chloranyl-2-sulfanylidene-1H-4,1-benzoxazepin-5-one Openeye Name: 6-chloro-2-thioxo-1H-4,1-benzoxazepin-5-one CAS Name: 6-chloro-2-sulfanylidene-1H-4,1-benzoxazepin-5-one IUPAC Name: 6-chloro-2-sulfanylidene-1H-4,1-benzoxazepin-5-one Traditional Name: 6-chloro-2-thioxo-1H-4,1-benzoxazepin-5-one Formula: C9H6ClNO2S MolecularWeight: 227.66744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=S)NC2=C(C(=CC=C2)Cl)C(=O)O1

Isomeric SMILES

C1C(=S)NC2=C(C(=CC=C2)Cl)C(=O)O1

InChI

InChI=1S/C9H6ClNO2S/c10-5-2-1-3-6-8(5)9(12)13-4-7(14)11-6/h1-3H,4H2,(H,11,14)