4-(5-oxidanylidene-6H-benzo[b][1]benzothiepin-2-yl)-1,2,5-thiadiazol-3-one

Systemtic Name: 4-(5-oxidanylidene-6H-benzo[b][1]benzothiepin-2-yl)-1,2,5-thiadiazol-3-one Openeye Name: 4-(5-oxo-6H-benzo[b][1]benzothiepin-2-yl)-1,2,5-thiadiazol-3-one CAS Name: 4-(5-oxo-6H-benzo[b][1]benzothiepin-2-yl)-1,2,5-thiadiazol-3-one IUPAC Name: 4-(5-oxo-6H-benzo[b][1]benzothiepin-2-yl)-1,2,5-thiadiazol-3-one Traditional Name: 4-(5-keto-6H-benzo[b][1]benzothiepin-2-yl)-1,2,5-thiadiazol-3-one Formula: C16H10N2O2S2 MolecularWeight: 326.3928

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2SC3=C(C1=O)C=CC(=C3)C4=NSNC4=O

Isomeric SMILES

C1C2=CC=CC=C2SC3=C(C1=O)C=CC(=C3)C4=NSNC4=O

InChI

InChI=1S/C16H10N2O2S2/c19-12-7-9-3-1-2-4-13(9)21-14-8-10(5-6-11(12)14)15-16(20)18-22-17-15/h1-6,8H,7H2,(H,18,20)